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

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-iodo-2-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-iodo-2-methylphenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C17H17IN3OS+ MolecularWeight: 438.30585

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16IN3OS/c1-11-9-12(18)7-8-13(11)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