N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylacetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]acetamide Formula: C28H21ClN4O4S2 MolecularWeight: 577.07374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=CC=CC=C4SC5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC=C1N2C3=C(C=C(C=C3)[N+](=O)[O-])N=C2SCC(=O)NC4=CC=CC=C4SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H21ClN4O4S2/c1-37-25-8-4-3-7-24(25)32-23-15-12-19(33(35)36)16-22(23)31-28(32)38-17-27(34)30-21-6-2-5-9-26(21)39-20-13-10-18(29)11-14-20/h2-16H,17H2,1H3,(H,30,34)