5-(4-chlorophenyl)-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[(4-methoxy-3-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[(4-methoxy-3-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[(4-methoxy-3-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[(4-methoxy-3-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C19H14ClN3O5S MolecularWeight: 431.84956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN3O5S/c1-27-16-7-6-13(10-14(16)23(25)26)21-19(29)22-18(24)17-9-8-15(28-17)11-2-4-12(20)5-3-11/h2-10H,1H3,(H2,21,22,24,29)