8636027 -OEChem-03292410052D 47 49 0 1 0 0 0 0 0999 V2000 2.8660 -5.5442 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 1.9946 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0871 1.7855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0442 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4071 1.0435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6859 2.8036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5442 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 -0.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 1.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 3.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 2.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8669 4.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2846 3.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 3.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4602 5.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8779 4.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4656 5.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -0.5073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -1.5812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.5073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.5812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.7342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1994 0.8519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4835 4.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9202 3.3201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7698 3.1437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6326 4.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7666 3.8725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8246 5.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2613 4.8000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2135 6.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 20 2 0 0 0 0 7 4 1 6 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 11 1 0 0 0 0 5 15 2 0 0 0 0 6 15 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 27 1 0 0 0 0 8 11 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 14 2 0 0 0 0 12 16 1 0 0 0 0 12 35 1 0 0 0 0 13 17 2 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 16 18 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 1 0 0 0 0 21 40 1 0 0 0 0 22 25 2 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 4 1 M END > 8636027 > 1 > 452 > 3 > 1 > 6 > AAADceB7IABEAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAAAB0AAAHgYQAAAADCrF3iSz0ZPIEAisAyVydACC8KlhDzgJiJQYZoiIYCLhm5GUIAholQLIyCcQgIAOBAAAAAAAAAAIAAAAAAAAAAAAAAAAAA== > [2-(N-acetylanilino)thiazol-4-yl]methyl-[(1S)-1-(4-chlorophenyl)ethyl]ammonium > [2-(N-acetylanilino)-4-thiazolyl]methyl-[(1S)-1-(4-chlorophenyl)ethyl]ammonium > [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl-[(1S)-1-(4-chlorophenyl)ethyl]azanium > [2-(N-acetylanilino)-1,3-thiazol-4-yl]methyl-[(1S)-1-(4-chlorophenyl)ethyl]azanium > [(1S)-1-(4-chlorophenyl)ethyl]-[[2-[ethanoyl(phenyl)amino]-1,3-thiazol-4-yl]methyl]azanium > [2-(N-acetylanilino)thiazol-4-yl]methyl-[(1S)-1-(4-chlorophenyl)ethyl]ammonium > InChI=1S/C20H20ClN3OS/c1-14(16-8-10-17(21)11-9-16)22-12-18-13-26-20(23-18)24(15(2)25)19-6-4-3-5-7-19/h3-11,13-14,22H,12H2,1-2H3/p+1/t14-/m0/s1 > KFKZIHMDZLYILF-AWEZNQCLSA-O > 4.1 > 386.1093862 > C20H21ClN3OS+ > 386.9 > CC(C1=CC=C(C=C1)Cl)[NH2+]CC2=CSC(=N2)N(C3=CC=CC=C3)C(=O)C > C[C@@H](C1=CC=C(C=C1)Cl)[NH2+]CC2=CSC(=N2)N(C3=CC=CC=C3)C(=O)C > 78 > 386.1093862 > 1 > 26 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 14 8 12 16 8 13 17 8 16 18 8 17 18 8 19 21 8 19 22 8 2 14 8 2 15 8 21 24 8 22 25 8 24 26 8 25 26 8 7 4 6 5 11 8 5 15 8 9 12 8 9 13 8 $$$$