4-methoxy-N-[4-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 4-methoxy-N-[4-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 4-methoxy-N-[4-[2-(4-nitroanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 4-methoxy-N-[4-[[2-(4-nitroanilino)-2-oxo-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 4-methoxy-N-[4-[2-(4-nitroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-(4-nitroanilino)-1-phenyl-ethyl]thio]phenyl]-4-methoxy-benzamide Formula: C28H23N3O5S MolecularWeight: 513.56432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H23N3O5S/c1-36-24-15-7-20(8-16-24)27(32)29-22-11-17-25(18-12-22)37-26(19-5-3-2-4-6-19)28(33)30-21-9-13-23(14-10-21)31(34)35/h2-18,26H,1H3,(H,29,32)(H,30,33)