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

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-homoveratryl-acetamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NCCC2=CC(=C(C=C2)OC)OC)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NCCC2=CC(=C(C=C2)OC)OC)C)C

InChI

InChI=1S/C21H31N3O3S/c1-6-7-12-24-16(3)15(2)23-21(24)28-14-20(25)22-11-10-17-8-9-18(26-4)19(13-17)27-5/h8-9,13H,6-7,10-12,14H2,1-5H3,(H,22,25)