N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-phenyl-1H-imidazol-2-yl)thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide Traditional Name: N-homoveratryl-2-[(5-phenyl-1H-imidazol-2-yl)thio]acetamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC=C(N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC=C(N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H23N3O3S/c1-26-18-9-8-15(12-19(18)27-2)10-11-22-20(25)14-28-21-23-13-17(24-21)16-6-4-3-5-7-16/h3-9,12-13H,10-11,14H2,1-2H3,(H,22,25)(H,23,24)