2,6-dimethoxy-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 2,6-dimethoxy-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]benzamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C16H15N3O6S MolecularWeight: 377.3718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O6S/c1-24-12-4-3-5-13(25-2)14(12)15(21)18-16(26)17-10-8-9(19(22)23)6-7-11(10)20/h3-8,20H,1-2H3,(H2,17,18,21,26)