3-methoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 3-methoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 3-methoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 3-methoxy-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-methoxy-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3-methoxy-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O4S/c1-22-13-4-2-3-10(9-13)14(19)17-15(23)16-11-5-7-12(8-6-11)18(20)21/h2-9H,1H3,(H2,16,17,19,23)