71562778 -OEChem-04262403182D 85 88 0 0 0 0 0 0 0999 V2000 12.3923 0.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 5.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -8.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -11.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -9.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 10.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -9.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 7.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -7.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -7.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -9.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 6.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -10.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 7.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 8.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 8.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 9.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 11.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -11.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 11.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7162 -1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5822 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1836 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -6.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -9.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -6.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -7.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3142 5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9157 4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -8.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 2.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 1.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -10.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 6.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 8.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9893 8.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0463 11.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6477 10.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -10.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -11.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -12.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4344 10.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 11.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8144 12.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 37 1 0 0 0 0 2 42 1 0 0 0 0 3 34 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 26 1 0 0 0 0 5 29 1 0 0 0 0 6 23 1 0 0 0 0 6 40 1 0 0 0 0 7 24 2 0 0 0 0 8 35 2 0 0 0 0 9 43 1 0 0 0 0 9 50 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 43 2 0 0 0 0 12 48 2 0 0 0 0 13 18 1 0 0 0 0 13 24 1 0 0 0 0 13 58 1 0 0 0 0 14 21 1 0 0 0 0 14 35 1 0 0 0 0 14 63 1 0 0 0 0 15 31 2 0 0 0 0 15 41 1 0 0 0 0 16 42 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 22 1 0 0 0 0 20 25 2 0 0 0 0 21 23 1 0 0 0 0 21 27 2 0 0 0 0 22 23 2 0 0 0 0 22 59 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 62 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 33 2 0 0 0 0 30 64 1 0 0 0 0 31 36 1 0 0 0 0 32 34 2 0 0 0 0 32 65 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 35 37 1 0 0 0 0 36 38 2 0 0 0 0 36 67 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 38 39 1 0 0 0 0 38 70 1 0 0 0 0 39 41 2 0 0 0 0 39 43 1 0 0 0 0 40 71 1 0 0 0 0 40 72 1 0 0 0 0 40 73 1 0 0 0 0 41 74 1 0 0 0 0 42 44 1 0 0 0 0 44 46 2 0 0 0 0 44 75 1 0 0 0 0 45 46 1 0 0 0 0 45 47 2 0 0 0 0 45 48 1 0 0 0 0 46 76 1 0 0 0 0 47 77 1 0 0 0 0 49 51 1 0 0 0 0 49 78 1 0 0 0 0 49 79 1 0 0 0 0 50 80 1 0 0 0 0 50 81 1 0 0 0 0 50 82 1 0 0 0 0 51 83 1 0 0 0 0 51 84 1 0 0 0 0 51 85 1 0 0 0 0 M END > 71562778 > 1 > 1130 > 13 > 2 > 19 > AAADcfB/vQBEAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAAAB9AAAHwYQAAAADA7l3i6+z5LIFAioAzX3XAKC2CB1L3AI2Ll/b9gOJ/vlt5+HOajn1hX46ce4+f+eAGABCAIAGAAAwAIQBAAwAAAAAAAAAA== > methyl 6-[3-[2-[3-[2-chloro-4-[[2-[(5-ethoxycarbonyl-2-pyridyl)sulfanyl]acetyl]amino]-5-methoxy-phenoxy]propylamino]-2-oxo-ethoxy]-5-fluoro-phenyl]pyridine-3-carboxylate > 6-[3-[2-[3-[2-chloro-4-[[2-[(5-ethoxycarbonyl-2-pyridinyl)thio]-1-oxoethyl]amino]-5-methoxyphenoxy]propylamino]-2-oxoethoxy]-5-fluorophenyl]-3-pyridinecarboxylic acid methyl ester > methyl 6-[3-[2-[3-[2-chloro-4-[[2-(5-ethoxycarbonylpyridin-2-yl)sulfanylacetyl]amino]-5-methoxyphenoxy]propylamino]-2-oxoethoxy]-5-fluorophenyl]pyridine-3-carboxylate > methyl 6-[3-[2-[3-[2-chloro-4-[[2-(5-ethoxycarbonylpyridin-2-yl)sulfanylacetyl]amino]-5-methoxyphenoxy]propylamino]-2-oxoethoxy]-5-fluorophenyl]pyridine-3-carboxylate > methyl 6-[3-[2-[3-[2-chloranyl-4-[2-(5-ethoxycarbonylpyridin-2-yl)sulfanylethanoylamino]-5-methoxy-phenoxy]propylamino]-2-oxidanylidene-ethoxy]-5-fluoranyl-phenyl]pyridine-3-carboxylate > 6-[3-[2-[3-[4-[[2-[(5-carbethoxy-2-pyridyl)thio]acetyl]amino]-2-chloro-5-methoxy-phenoxy]propylamino]-2-keto-ethoxy]-5-fluoro-phenyl]nicotinic acid methyl ester > InChI=1S/C35H34ClFN4O9S/c1-4-48-35(45)22-7-9-33(40-18-22)51-20-32(43)41-28-15-26(36)29(16-30(28)46-2)49-11-5-10-38-31(42)19-50-25-13-23(12-24(37)14-25)27-8-6-21(17-39-27)34(44)47-3/h6-9,12-18H,4-5,10-11,19-20H2,1-3H3,(H,38,42)(H,41,43) > DNVCZZLHLYWPPB-UHFFFAOYSA-N > 5.3 > 740.1719057 > C35H34ClFN4O9S > 741.2 > CCOC(=O)C1=CN=C(C=C1)SCC(=O)NC2=CC(=C(C=C2OC)OCCCNC(=O)COC3=CC(=CC(=C3)C4=NC=C(C=C4)C(=O)OC)F)Cl > CCOC(=O)C1=CN=C(C=C1)SCC(=O)NC2=CC(=C(C=C2OC)OCCCNC(=O)COC3=CC(=CC(=C3)C4=NC=C(C=C4)C(=O)OC)F)Cl > 190 > 740.1719057 > 0 > 51 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 15 31 8 15 41 8 16 42 8 16 47 8 20 22 8 20 25 8 21 23 8 21 27 8 22 23 8 25 27 8 28 30 8 28 32 8 29 30 8 29 33 8 31 36 8 32 34 8 33 34 8 36 38 8 38 39 8 39 41 8 42 44 8 44 46 8 45 46 8 45 47 8 $$$$