N-[(2,4-dimethoxyphenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[(2,4-dimethoxyanilino)-sulfanylidenemethyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(2,4-dimethoxyphenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(2,4-dimethoxyphenyl)thiocarbamoyl]-5-(3-nitrophenyl)-2-furamide Formula: C20H17N3O6S MolecularWeight: 427.43048

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O6S/c1-27-14-6-7-15(18(11-14)28-2)21-20(30)22-19(24)17-9-8-16(29-17)12-4-3-5-13(10-12)23(25)26/h3-11H,1-2H3,(H2,21,22,24,30)