69292070 -OEChem-05092402522D 70 74 0 1 0 0 0 0 0999 V2000 8.4597 -2.2743 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.2906 -0.9294 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -1.7903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 2.9291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9844 1.3157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7489 2.4517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -4.7903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -1.7903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 0.2975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4844 0.4497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -2.7903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -3.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -3.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -4.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -4.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -5.7903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -6.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -6.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -1.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -0.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7631 -0.0116 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5030 1.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 0.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 1.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 -0.8596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 0.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7786 2.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9184 -1.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4017 1.6521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6844 -2.4296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5325 -1.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3152 2.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3596 3.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 4.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6947 4.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9406 5.5710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2459 6.2903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2756 6.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6739 -2.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6136 -3.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -2.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0589 -2.7077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6604 -3.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -4.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6136 -4.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6604 -4.1827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0589 -4.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6739 -5.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -1.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -5.7534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -6.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -6.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -6.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5399 -6.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -5.7534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3814 -0.5001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6043 0.1059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1386 1.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3168 -1.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8648 1.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6412 -3.0481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4441 2.6653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9169 3.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 4.3920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5238 3.7718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5422 5.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3984 4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4168 6.8863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 6.4944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 25 1 0 0 0 0 2 31 1 0 0 0 0 3 19 2 0 0 0 0 4 27 1 0 0 0 0 4 33 1 0 0 0 0 5 10 1 0 0 0 0 5 32 1 0 0 0 0 6 27 2 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 8 50 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 26 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 49 1 0 0 0 0 17 51 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 18 56 1 0 0 0 0 19 20 1 0 0 0 0 20 23 2 0 0 0 0 21 25 1 0 0 0 0 21 26 1 0 0 0 0 21 57 1 0 0 0 0 22 24 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 59 1 0 0 0 0 25 28 2 0 0 0 0 26 29 1 0 0 0 0 28 30 1 0 0 0 0 28 60 1 0 0 0 0 29 32 2 0 0 0 0 29 61 1 0 0 0 0 30 31 2 0 0 0 0 30 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 35 66 1 0 0 0 0 36 38 2 0 0 0 0 36 67 1 0 0 0 0 37 39 2 0 0 0 0 37 68 1 0 0 0 0 38 39 1 0 0 0 0 38 69 1 0 0 0 0 39 70 1 0 0 0 0 M END > 69292070 > 1 > 823 > 7 > 1 > 10 > AAADceB7uABEAAAAAAAAAAAAAAAAAWLEgAA8QAAAAAAAAAAB/AAAHgYUAAAADCrh3iYyjZPcFAitAy3y3gSDgKAnLzBo2Lm+btoKZvrh97uXMYhm1hn46ce82aOeAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > benzyl 1-[(5-chloro-2-thienyl)-isoxazol-3-yl-methyl]-5-[(1-isopropyl-4-piperidyl)carbamoyl]pyrrole-2-carboxylate > 1-[(5-chloro-2-thiophenyl)-(3-isoxazolyl)methyl]-5-[oxo-[(1-propan-2-yl-4-piperidinyl)amino]methyl]-2-pyrrolecarboxylic acid (phenylmethyl) ester > benzyl 1-[(5-chlorothiophen-2-yl)-(1,2-oxazol-3-yl)methyl]-5-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]pyrrole-2-carboxylate > benzyl 1-[(5-chlorothiophen-2-yl)-(1,2-oxazol-3-yl)methyl]-5-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]pyrrole-2-carboxylate > (phenylmethyl) 1-[(5-chloranylthiophen-2-yl)-(1,2-oxazol-3-yl)methyl]-5-[(1-propan-2-ylpiperidin-4-yl)carbamoyl]pyrrole-2-carboxylate > 1-[(5-chloro-2-thienyl)-isoxazol-3-yl-methyl]-5-[(1-isopropyl-4-piperidyl)carbamoyl]pyrrole-2-carboxylic acid benzyl ester > InChI=1S/C29H31ClN4O4S/c1-19(2)33-15-12-21(13-16-33)31-28(35)23-8-9-24(29(36)37-18-20-6-4-3-5-7-20)34(23)27(22-14-17-38-32-22)25-10-11-26(30)39-25/h3-11,14,17,19,21,27H,12-13,15-16,18H2,1-2H3,(H,31,35) > RHEDMDTWUNYDDC-UHFFFAOYSA-N > 5.8 > 566.1754544 > C29H31ClN4O4S > 567.1 > CC(C)N1CCC(CC1)NC(=O)C2=CC=C(N2C(C3=NOC=C3)C4=CC=C(S4)Cl)C(=O)OCC5=CC=CC=C5 > CC(C)N1CCC(CC1)NC(=O)C2=CC=C(N2C(C3=NOC=C3)C4=CC=C(S4)Cl)C(=O)OCC5=CC=CC=C5 > 118 > 566.1754544 > 0 > 39 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 26 8 2 25 8 2 31 8 20 23 8 21 26 3 22 24 8 23 24 8 25 28 8 26 29 8 28 30 8 29 32 8 30 31 8 34 35 8 34 36 8 35 37 8 36 38 8 37 39 8 38 39 8 5 10 8 5 32 8 9 20 8 9 22 8 $$$$