N-[2-methyl-5-[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylamino]phenyl]benzamide

Systemtic Name: N-[2-methyl-5-[2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylamino]phenyl]benzamide Openeye Name: N-[5-[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]amino]-2-methyl-phenyl]benzamide CAS Name: N-[2-methyl-5-[[1-oxo-2-[[3-(phenylmethyl)-1H-benzimidazol-3-ium-2-yl]thio]ethyl]amino]phenyl]benzamide IUPAC Name: N-[5-[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetyl]amino]-2-methylphenyl]benzamide Traditional Name: N-[5-[[2-[(3-benzyl-1H-benzimidazol-3-ium-2-yl)thio]acetyl]amino]-2-methyl-phenyl]benzamide Formula: C30H27N4O2S+ MolecularWeight: 507.62598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=[N+](C3=CC=CC=C3N2)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C30H26N4O2S/c1-21-16-17-24(18-26(21)32-29(36)23-12-6-3-7-13-23)31-28(35)20-37-30-33-25-14-8-9-15-27(25)34(30)19-22-10-4-2-5-11-22/h2-18H,19-20H2,1H3,(H2,31,32,35,36)/p+1