20801186 -OEChem-05112401552D 75 80 0 0 0 0 0 0 0999 V2000 4.4665 -3.3298 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.2459 -3.2334 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8087 -1.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7123 -4.3595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.1193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.8752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -1.9966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3087 3.0834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8087 0.4854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7250 -1.1854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5775 -3.8580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3087 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8087 2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3087 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3087 3.0834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8087 2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8087 3.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3087 4.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8087 3.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3087 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3087 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7250 0.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0357 -2.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3679 -2.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3732 -2.7774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9680 -3.6916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9902 -3.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5851 -4.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5904 -4.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3808 -3.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.5261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9987 0.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2836 1.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2836 2.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7261 1.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4163 0.7408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8913 3.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2010 3.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3337 2.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3337 1.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4287 3.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4287 0.4854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8456 4.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6187 5.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7717 5.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8087 4.5695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1887 3.9495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8087 3.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9177 1.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4183 -2.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5826 -1.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -2.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -1.1906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8472 1.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0502 1.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -5.3519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1763 -5.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 1.6331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 2.1107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 1.3753 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 39 1 0 0 0 0 7 44 1 0 0 0 0 8 42 1 0 0 0 0 8 44 1 0 0 0 0 9 44 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 46 1 0 0 0 0 15 47 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 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 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 21 61 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 37 70 1 0 0 0 0 38 40 1 0 0 0 0 38 71 1 0 0 0 0 39 42 2 0 0 0 0 40 41 2 0 0 0 0 40 72 1 0 0 0 0 42 43 1 0 0 0 0 43 73 1 0 0 0 0 43 74 1 0 0 0 0 43 75 1 0 0 0 0 M END > 20801186 > 1 > 1120 > 10 > 1 > 10 > AAADceB7uABEAAAAAAAAAAAAAAAAAWLEiAA8QAAAAAAAAFgB/gAAHgYUAAAADC7h3iYyzfPcFAitA6XyXgCDiKAnLzBo2Lm+btoZZvrh97u2MYhm1hnu6ce82eOeCAACAAACAAAQAAQAAAQAAAAAAAAAAA== > (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 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 (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester > (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylate > (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl]-2-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]indole-5-carboxylate > (5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 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 (2-keto-5-methyl-1,3-dioxol-4-yl)methyl ester > InChI=1S/C31H31ClN4O7S/c1-17(2)35-10-8-21(9-11-35)33-29(37)24-13-20-12-19(30(38)40-16-26-18(3)41-31(39)42-26)4-5-23(20)36(24)15-22-14-25(43-34-22)27-6-7-28(32)44-27/h4-7,12-14,17,21H,8-11,15-16H2,1-3H3,(H,33,37) > XPOQWRBKJPJWTP-UHFFFAOYSA-N > 5.5 > 638.1601982 > C31H31ClN4O7S > 639.1 > CC1=C(OC(=O)O1)COC(=O)C2=CC3=C(C=C2)N(C(=C3)C(=O)NC4CCN(CC4)C(C)C)CC5=NOC(=C5)C6=CC=C(S6)Cl > CC1=C(OC(=O)O1)COC(=O)C2=CC3=C(C=C2)N(C(=C3)C(=O)NC4CCN(CC4)C(C)C)CC5=NOC(=C5)C6=CC=C(S6)Cl > 153 > 638.1601982 > 0 > 44 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 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 38 40 8 39 42 8 4 13 8 4 35 8 40 41 8 7 39 8 7 44 8 8 42 8 8 44 8 $$$$