20801164 -OEChem-05181307522D 79 83 0 1 0 0 0 0 0999 V2000 6.8040 5.1363 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.4665 4.4948 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 0.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5937 4.0387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.9401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -3.4042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 -0.8061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 0.8646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4589 3.5372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -1.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6901 -2.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -1.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -3.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6901 -2.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6901 -4.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -5.1363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6901 -4.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -0.7448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9171 1.8152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2493 2.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2546 2.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8494 3.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8716 3.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9401 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1274 2.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 3.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4718 4.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8101 -1.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2977 -1.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6075 -1.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1650 -2.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1650 -2.1396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 -2.1396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 -2.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0824 -4.0148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7727 -3.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3801 -3.7333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3101 -0.8061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6901 -3.6502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0701 -4.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6901 -4.8902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6531 -5.4462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5001 -5.6732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7270 -4.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 -1.3342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 1.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2997 2.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 0.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9437 1.9202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1911 2.2960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 -1.9401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 -1.9401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6954 3.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.0968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 41 1 0 0 0 0 2 36 1 0 0 0 0 2 41 1 0 0 0 0 3 22 2 0 0 0 0 4 13 1 0 0 0 0 4 35 1 0 0 0 0 5 34 1 0 0 0 0 5 37 1 0 0 0 0 6 34 2 0 0 0 0 7 37 1 0 0 0 0 7 42 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 42 2 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 14 1 0 0 0 0 11 22 1 0 0 0 0 11 55 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 27 1 0 0 0 0 13 30 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 45 1 0 0 0 0 15 17 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 18 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 54 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 24 26 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 62 1 0 0 0 0 26 29 1 0 0 0 0 27 30 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 32 2 0 0 0 0 28 65 1 0 0 0 0 29 31 2 0 0 0 0 29 66 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 34 1 0 0 0 0 32 67 1 0 0 0 0 33 35 2 0 0 0 0 33 68 1 0 0 0 0 35 36 1 0 0 0 0 36 38 2 0 0 0 0 37 39 1 0 0 0 0 37 69 1 0 0 0 0 38 40 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 40 41 2 0 0 0 0 40 74 1 0 0 0 0 43 44 1 0 0 0 0 43 75 1 0 0 0 0 43 76 1 0 0 0 0 44 77 1 0 0 0 0 44 78 1 0 0 0 0 44 79 1 0 0 0 0 M END > 20801164 > 1 > 1000 > 10 > 1 > 13 > AAADcfB7uABEAAAAAAAAAAAAAAAAAWLEgAA8QAAAAAAAAFgB/gAAHgYUAAAADC7x3icyzfPcFAitA6XyXgCDgKAnLzBo2Lm+btoYZvrh97u2MYhm1hns6ce82eOeCAACAAACAAAQAAQAAAQAAAAAAAAAAA== > 1-ethoxycarbonyloxyethyl 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-2-[(1-isopropyl-4-piperidyl)carbamoyl]indole-5-carboxylate > 1-[[5-(5-chloro-2-thiophenyl)-3-isoxazolyl]methyl]-2-[oxo-[(1-propan-2-yl-4-piperidinyl)amino]methyl]-5-indolecarboxylic acid 1-ethoxycarbonyloxyethyl ester > 1-ethoxycarbonyloxyethyl 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylate > 1-ethoxycarbonyloxyethyl 1-[[5-(5-chloranylthiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylate > 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-2-[(1-isopropyl-4-piperidyl)carbamoyl]indole-5-carboxylic acid 1-carbethoxyoxyethyl ester > InChI=1S/C31H35ClN4O7S/c1-5-40-31(39)42-19(4)41-30(38)20-6-7-24-21(14-20)15-25(29(37)33-22-10-12-35(13-11-22)18(2)3)36(24)17-23-16-26(43-34-23)27-8-9-28(32)44-27/h6-9,14-16,18-19,22H,5,10-13,17H2,1-4H3,(H,33,37) > GJTKAAFWJZWEPS-UHFFFAOYSA-N > 6.5 > 642.191498 > C31H35ClN4O7S > 643.1502 > CCOC(=O)OC(C)OC(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)NC3CCN(CC3)C(C)C)CC4=NOC(=C4)C5=CC=C(S5)Cl > CCOC(=O)OC(C)OC(=O)C1=CC2=C(C=C1)N(C(=C2)C(=O)NC3CCN(CC3)C(C)C)CC4=NOC(=C4)C5=CC=C(S5)Cl > 153 > 642.191498 > 0 > 44 > 0 > 1 > 0 > 0 > 0 > 1 > 2 > 1 5 255 > 12 23 8 12 24 8 13 30 8 2 36 8 2 41 8 23 25 8 24 26 8 24 28 8 25 26 8 26 29 8 28 32 8 29 31 8 30 33 8 31 32 8 33 35 8 36 38 8 37 39 3 38 40 8 4 13 8 4 35 8 40 41 8 $$$$