N-[4-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-phenyl-ethanamide Openeye Name: N-[4-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]-2-phenyl-acetamide CAS Name: N-[4-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]-2-phenylacetamide IUPAC Name: N-[4-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]-2-phenylacetamide Traditional Name: N-[4-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]-2-phenyl-acetamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c26-21(14-16-4-2-1-3-5-16)23-18-8-12-20(13-9-18)30-15-22(27)24-17-6-10-19(11-7-17)25(28)29/h1-13H,14-15H2,(H,23,26)(H,24,27)