N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-phenylthiazol-2-yl)sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-phenyl-2-thiazolyl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetamide Traditional Name: N-homoveratryl-2-[(4-phenylthiazol-2-yl)thio]acetamide Formula: C21H22N2O3S2 MolecularWeight: 414.54098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC(=CS2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC(=CS2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N2O3S2/c1-25-18-9-8-15(12-19(18)26-2)10-11-22-20(24)14-28-21-23-17(13-27-21)16-6-4-3-5-7-16/h3-9,12-13H,10-11,14H2,1-2H3,(H,22,24)