N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[2-(3,4-dimethoxyphenyl)ethylamino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethylcarbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-(homoveratrylthiocarbamoyl)-3,4,5-trimethoxy-benzamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6S/c1-25-15-7-6-13(10-16(15)26-2)8-9-22-21(30)23-20(24)14-11-17(27-3)19(29-5)18(12-14)28-4/h6-7,10-12H,8-9H2,1-5H3,(H2,22,23,24,30)