N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: N-[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: N-(homoveratrylthiocarbamoyl)-3-(p-tolyl)acrylamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H24N2O3S/c1-15-4-6-16(7-5-15)9-11-20(24)23-21(27)22-13-12-17-8-10-18(25-2)19(14-17)26-3/h4-11,14H,12-13H2,1-3H3,(H2,22,23,24,27)