70173002 -OEChem-03292401362D 49 51 0 1 0 0 0 0 0999 V2000 4.5981 -2.4059 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 4.0486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8366 3.0886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3092 2.3260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4793 3.8395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0941 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6456 1.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.4305 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8147 3.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 3.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8916 3.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2121 2.4318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3356 1.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1472 1.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5369 1.8517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3811 3.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6231 3.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3758 3.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -0.0136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 0.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 0.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -0.0136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -0.7982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -0.7982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5614 1.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7207 2.4345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4488 2.7587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 3.7747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2272 4.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 13 2 0 0 0 0 3 19 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 4 32 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 11 1 0 0 0 0 7 19 1 0 0 0 0 7 41 1 0 0 0 0 8 22 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 1 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 25 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 M END > 70173002 > 1 > 484 > 5 > 3 > 4 > AAADceB7sAAEAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAAABAAAAHgIQAAAACCrBkCQwwIPAAACIACVSUACCAAAhBwAIiIGIZogIYDLB07HUIAhglgDIyAccAQAAAAAAAAAAABAAAAAAAAAAIAAAAAAAAA== > 2-amino-N-[(5S)-5-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidin-3-yl]acetamide > 2-amino-N-[(5S)-5-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]-3-pyrrolidinyl]acetamide > 2-amino-N-[(5S)-5-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidin-3-yl]acetamide > 2-amino-N-[(5S)-5-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidin-3-yl]acetamide > 2-azanyl-N-[(5S)-5-[4-(2-chlorophenyl)piperazin-1-yl]carbonylpyrrolidin-3-yl]ethanamide > 2-amino-N-[(5S)-5-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidin-3-yl]acetamide > InChI=1S/C17H24ClN5O2/c18-13-3-1-2-4-15(13)22-5-7-23(8-6-22)17(25)14-9-12(11-20-14)21-16(24)10-19/h1-4,12,14,20H,5-11,19H2,(H,21,24)/t12?,14-/m0/s1 > IBMAXKXNYMEFSV-PYMCNQPYSA-N > 0.2 > 365.1618527 > C17H24ClN5O2 > 365.9 > C1CN(CCN1C2=CC=CC=C2Cl)C(=O)C3CC(CN3)NC(=O)CN > C1CN(CCN1C2=CC=CC=C2Cl)C(=O)[C@@H]3CC(CN3)NC(=O)CN > 90.7 > 365.1618527 > 0 > 25 > 1 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 18 20 8 18 21 8 20 23 8 21 24 8 23 25 8 24 25 8 11 7 3 9 13 5 $$$$