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

Systemtic Name: 5-(3,4-dichlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dichlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dichlorophenyl)-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dichlorophenyl)-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dichlorophenyl)-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C19H13Cl2N3O5S MolecularWeight: 466.29462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13Cl2N3O5S/c1-28-11-3-5-14(15(9-11)24(26)27)22-19(30)23-18(25)17-7-6-16(29-17)10-2-4-12(20)13(21)8-10/h2-9H,1H3,(H2,22,23,25,30)