N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2-[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2-[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(4-hydroxy-3,5-dimethyl-benzyl)-2-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]acetamide Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O5S/c1-15-10-17(11-16(2)24(15)31)13-26-23(30)14-35-25-27-19-12-18(29(32)33)8-9-20(19)28(25)21-6-4-5-7-22(21)34-3/h4-12,31H,13-14H2,1-3H3,(H,26,30)