N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-phenyl-propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-phenyl-propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-phenyl-propanamide CAS Name: N-[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]-3-phenylpropanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3-phenylpropanamide Traditional Name: N-(homoveratrylthiocarbamoyl)-3-phenyl-propionamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC(=O)CCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC(=O)CCC2=CC=CC=C2)OC

InChI

InChI=1S/C20H24N2O3S/c1-24-17-10-8-16(14-18(17)25-2)12-13-21-20(26)22-19(23)11-9-15-6-4-3-5-7-15/h3-8,10,14H,9,11-13H2,1-2H3,(H2,21,22,23,26)