(E)-3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-3-(3,4-dimethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]acrylamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NC(=O)/C=C/C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H22N2O5S/c1-24-14-7-9-16(25-2)15(12-14)21-20(28)22-19(23)10-6-13-5-8-17(26-3)18(11-13)27-4/h5-12H,1-4H3,(H2,21,22,23,28)/b10-6+