(E)-N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Openeye Name: (E)-N-[(4-chloro-2,5-dimethoxy-phenyl)carbamothioyl]-3-(5-phenyl-2-furyl)prop-2-enamide CAS Name: (E)-N-[(4-chloro-2,5-dimethoxyanilino)-sulfanylidenemethyl]-3-(5-phenyl-2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]-3-(5-phenylfuran-2-yl)prop-2-enamide Traditional Name: (E)-N-[(4-chloro-2,5-dimethoxy-phenyl)thiocarbamoyl]-3-(5-phenyl-2-furyl)acrylamide Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C22H19ClN2O4S/c1-27-19-13-17(20(28-2)12-16(19)23)24-22(30)25-21(26)11-9-15-8-10-18(29-15)14-6-4-3-5-7-14/h3-13H,1-2H3,(H2,24,25,26,30)/b11-9+