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

Systemtic Name: N-[2-methyl-5-[2-[[3-(phenylsulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]ethanoylamino]phenyl]benzamide Openeye Name: N-[5-[[2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetyl]amino]-2-methyl-phenyl]benzamide CAS Name: N-[5-[[2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]thio]-1-oxoethyl]amino]-2-methylphenyl]benzamide IUPAC Name: N-[5-[[2-[[3-(benzenesulfonyl)-1H-benzimidazol-3-ium-2-yl]sulfanyl]acetyl]amino]-2-methylphenyl]benzamide Traditional Name: N-[5-[[2-[(3-besyl-1H-benzimidazol-3-ium-2-yl)thio]acetyl]amino]-2-methyl-phenyl]benzamide Formula: C29H25N4O4S2+ MolecularWeight: 557.6632

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H24N4O4S2/c1-20-16-17-22(18-25(20)31-28(35)21-10-4-2-5-11-21)30-27(34)19-38-29-32-24-14-8-9-15-26(24)33(29)39(36,37)23-12-6-3-7-13-23/h2-18H,19H2,1H3,(H2,30,31,34,35)/p+1