N-(4-bromanyl-3-methyl-phenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-(1-phenylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[(1-phenylbenzimidazol-2-yl)thio]acetamide Formula: C22H18BrN3OS MolecularWeight: 452.36682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=CC=C4)Br

InChI

InChI=1S/C22H18BrN3OS/c1-15-13-16(11-12-18(15)23)24-21(27)14-28-22-25-19-9-5-6-10-20(19)26(22)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,27)