N-(4-bromanyl-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C17H17BrN3OS+ MolecularWeight: 391.30538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)C)Br

InChI

InChI=1S/C17H16BrN3OS/c1-11-9-12(7-8-13(11)18)19-16(22)10-23-17-20-14-5-3-4-6-15(14)21(17)2/h3-9H,10H2,1-2H3,(H,19,22)/p+1