60608662 -OEChem-03282421152D 55 57 0 0 0 0 0 0 0999 V2000 6.1808 -1.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.3433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -2.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1090 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 -1.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 -2.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 -3.2046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 -3.5421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -0.8063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 -0.9788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -3.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0982 -2.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9162 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7133 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5668 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1682 1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1079 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -1.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9138 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3158 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4190 1.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6459 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7990 2.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6229 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2429 -0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8629 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 11 2 0 0 0 0 3 19 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 5 16 1 0 0 0 0 5 19 1 0 0 0 0 5 42 1 0 0 0 0 6 17 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 19 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 41 1 0 0 0 0 20 25 1 0 0 0 0 20 43 1 0 0 0 0 21 24 2 0 0 0 0 21 44 1 0 0 0 0 22 26 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END > 60608662 > 1 > 522 > 4 > 1 > 7 > AAADceB7MABAAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAAABQAAAHgQQAAAADAjF2ASywYPAAAiIAiVSUACCAAAlChAIiJkIZMgIIDLglZGEIQhghgDoyYcYiACOAAAAQAAEAAAAAACAAAgAAAAAAAAAAA== > N-[[3-(dimethylamino)phenyl]methyl]-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide > N-[[3-(dimethylamino)phenyl]methyl]-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide > N-[[3-(dimethylamino)phenyl]methyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide > N-[[3-(dimethylamino)phenyl]methyl]-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide > N-[[3-(dimethylamino)phenyl]methyl]-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide > N-[3-(dimethylamino)benzyl]-2-[(2-keto-2-pyrrolidino-ethyl)thio]benzamide > InChI=1S/C22H27N3O2S/c1-24(2)18-9-7-8-17(14-18)15-23-22(27)19-10-3-4-11-20(19)28-16-21(26)25-12-5-6-13-25/h3-4,7-11,14H,5-6,12-13,15-16H2,1-2H3,(H,23,27) > DEIMIZSRKZPEIE-UHFFFAOYSA-N > 3.3 > 397.18239829 > C22H27N3O2S > 397.5 > CN(C)C1=CC=CC(=C1)CNC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3 > CN(C)C1=CC=CC(=C1)CNC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3 > 78 > 397.18239829 > 0 > 28 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 14 8 13 20 8 14 22 8 15 18 8 15 21 8 17 18 8 17 23 8 20 25 8 21 24 8 22 26 8 23 24 8 25 26 8 $$$$