3,4,5-trimethoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[(4-methoxy-3-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(4-methoxy-3-nitrophenyl)carbamothioyl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(4-methoxy-3-nitro-phenyl)thiocarbamoyl]benzamide Formula: C18H19N3O7S MolecularWeight: 421.42436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O7S/c1-25-13-6-5-11(9-12(13)21(23)24)19-18(29)20-17(22)10-7-14(26-2)16(28-4)15(8-10)27-3/h5-9H,1-4H3,(H2,19,20,22,29)