N-[3-[(3-methylsulfanylphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(3-methylsulfanylphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(3-methylsulfanylanilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[3-(methylthio)anilino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(3-methylsulfanylanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[3-(methylthio)anilino]propyl]-4-nitro-benzamide Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4S/c1-25-15-4-2-3-13(11-15)19-16(21)9-10-18-17(22)12-5-7-14(8-6-12)20(23)24/h2-8,11H,9-10H2,1H3,(H,18,22)(H,19,21)