4-(azepan-1-ylsulfonyl)-N-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)carbothioyl-benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)carbothioyl-benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(6-methylimidazo[2,1-b]thiazole-5-carbothioyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[(6-methyl-5-imidazo[2,1-b]thiazolyl)-sulfanylidenemethyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(6-methylimidazo[2,1-b][1,3]thiazole-5-carbothioyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(6-methylimidazo[2,1-b]thiazole-5-carbothioyl)benzamide Formula: C20H22N4O3S3 MolecularWeight: 462.60868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CSC2=N1)C(=S)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(N2C=CSC2=N1)C(=S)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C20H22N4O3S3/c1-14-17(24-12-13-29-20(24)21-14)19(28)22-18(25)15-6-8-16(9-7-15)30(26,27)23-10-4-2-3-5-11-23/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,25,28)