N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide

Systemtic Name: N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]butanamide Openeye Name: N-[3-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[3-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]butanamide IUPAC Name: N-[3-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]butanamide Traditional Name: N-[3-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]butyramide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-2-4-17(22)20-14-5-3-6-16(11-14)26-12-18(23)19-13-7-9-15(10-8-13)21(24)25/h3,5-11H,2,4,12H2,1H3,(H,19,23)(H,20,22)