N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[(3,4-dimethoxyanilino)-sulfanylidenemethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)carbamothioyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[(3,4-dimethoxyphenyl)thiocarbamoyl]-4-methoxy-3-nitro-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=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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