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

Systemtic Name: 4-(4-methylsulfanylphenyl)-N-[2-[(4-nitrophenyl)amino]ethyl]-4-oxidanylidene-butanamide Openeye Name: 4-(4-methylsulfanylphenyl)-N-[2-(4-nitroanilino)ethyl]-4-oxo-butanamide CAS Name: 4-[4-(methylthio)phenyl]-N-[2-(4-nitroanilino)ethyl]-4-oxobutanamide IUPAC Name: 4-(4-methylsulfanylphenyl)-N-[2-(4-nitroanilino)ethyl]-4-oxobutanamide Traditional Name: 4-keto-4-[4-(methylthio)phenyl]-N-[2-(4-nitroanilino)ethyl]butyramide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4S/c1-27-17-8-2-14(3-9-17)18(23)10-11-19(24)21-13-12-20-15-4-6-16(7-5-15)22(25)26/h2-9,20H,10-13H2,1H3,(H,21,24)