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

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(4-hexoxyphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(4-hexoxyphenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(4-hexoxyanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(4-hexoxyphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[(4-hexoxyphenyl)thiocarbamoyl]acrylamide Formula: C24H30N2O4S MolecularWeight: 442.571

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C24H30N2O4S/c1-4-5-6-7-16-30-20-12-10-19(11-13-20)25-24(31)26-23(27)15-9-18-8-14-21(28-2)22(17-18)29-3/h8-15,17H,4-7,16H2,1-3H3,(H2,25,26,27,31)/b15-9+