N-(4-acetamido-3-chloranyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C18H17ClN4O2S MolecularWeight: 388.87118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)Cl

InChI

InChI=1S/C18H17ClN4O2S/c1-11(24)20-14-8-7-12(9-13(14)19)21-17(25)10-26-18-22-15-5-3-4-6-16(15)23(18)2/h3-9H,10H2,1-2H3,(H,20,24)(H,21,25)