N-[[4-[(2-chlorophenyl)carbonylamino]-3-methoxy-phenyl]carbamothioyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[[4-[(2-chlorophenyl)carbonylamino]-3-methoxy-phenyl]carbamothioyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]carbamothioyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-methoxyanilino]-sulfanylidenemethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]thiocarbamoyl]-4-methoxy-3-nitro-benzamide Formula: C23H19ClN4O6S MolecularWeight: 514.93816

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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)NC(=O)C3=CC=CC=C3Cl)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H19ClN4O6S/c1-33-19-10-7-13(11-18(19)28(31)32)21(29)27-23(35)25-14-8-9-17(20(12-14)34-2)26-22(30)15-5-3-4-6-16(15)24/h3-12H,1-2H3,(H,26,30)(H2,25,27,29,35)