(E)-3-(furan-2-yl)-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(furan-2-yl)-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-furyl)-N-[(2-methoxy-4-nitro-phenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-furanyl)-N-[(2-methoxy-4-nitroanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(furan-2-yl)-N-[(2-methoxy-4-nitrophenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-furyl)-N-[(2-methoxy-4-nitro-phenyl)thiocarbamoyl]acrylamide Formula: C15H13N3O5S MolecularWeight: 347.34582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)C=CC2=CC=CO2

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/C2=CC=CO2

InChI

InChI=1S/C15H13N3O5S/c1-22-13-9-10(18(20)21)4-6-12(13)16-15(24)17-14(19)7-5-11-3-2-8-23-11/h2-9H,1H3,(H2,16,17,19,24)/b7-5+