[5-[[4-(1H-benzimidazol-3-ium-2-yl)phenyl]carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide

Systemtic Name: [5-[[4-(1H-benzimidazol-3-ium-2-yl)phenyl]carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide Openeye Name: [5-[[4-(1H-benzimidazol-3-ium-2-yl)phenyl]carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide CAS Name: [5-[[4-(1H-benzimidazol-3-ium-2-yl)anilino]-oxomethyl]-2-methylphenyl]sulfonyl-(2-methoxyphenyl)azanide IUPAC Name: [5-[[4-(1H-benzimidazol-3-ium-2-yl)phenyl]carbamoyl]-2-methylphenyl]sulfonyl-(2-methoxyphenyl)azanide Traditional Name: [5-[[4-(1H-benzimidazol-3-ium-2-yl)phenyl]carbamoyl]-2-methyl-phenyl]sulfonyl-(2-methoxyphenyl)azanide Formula: C28H24N4O4S MolecularWeight: 512.57956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=[NH+]C4=CC=CC=C4N3)S(=O)(=O)[N-]C5=CC=CC=C5OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=[NH+]C4=CC=CC=C4N3)S(=O)(=O)[N-]C5=CC=CC=C5OC

InChI

InChI=1S/C28H23N4O4S/c1-18-11-12-20(17-26(18)37(34,35)32-24-9-5-6-10-25(24)36-2)28(33)29-21-15-13-19(14-16-21)27-30-22-7-3-4-8-23(22)31-27/h3-17H,1-2H3,(H2,29,30,31,33)/q-1/p+1