3,4-dimethoxy-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3,4-dimethoxy-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3,4-dimethoxy-N-[(2-methoxy-4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3,4-dimethoxy-N-[(2-methoxy-4-nitro-phenyl)thiocarbamoyl]benzamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H17N3O6S/c1-24-13-7-4-10(8-15(13)26-3)16(21)19-17(27)18-12-6-5-11(20(22)23)9-14(12)25-2/h4-9H,1-3H3,(H2,18,19,21,27)