N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4,5-diphenyl-1-prop-2-enyl-imidazol-2-yl)sulfanyl-pentanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4,5-diphenyl-1-prop-2-enyl-imidazol-2-yl)sulfanyl-pentanamide Openeye Name: 5-(1-allyl-4,5-diphenyl-imidazol-2-yl)sulfanyl-N-[2-(3,4-dimethoxyphenyl)ethyl]pentanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(4,5-diphenyl-1-prop-2-enyl-2-imidazolyl)thio]pentanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4,5-diphenyl-1-prop-2-enylimidazol-2-yl)sulfanylpentanamide Traditional Name: 5-[(1-allyl-4,5-diphenyl-imidazol-2-yl)thio]-N-homoveratryl-valeramide Formula: C33H37N3O3S MolecularWeight: 555.73018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCCCSC2=NC(=C(N2CC=C)C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCCCSC2=NC(=C(N2CC=C)C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C33H37N3O3S/c1-4-22-36-32(27-15-9-6-10-16-27)31(26-13-7-5-8-14-26)35-33(36)40-23-12-11-17-30(37)34-21-20-25-18-19-28(38-2)29(24-25)39-3/h4-10,13-16,18-19,24H,1,11-12,17,20-23H2,2-3H3,(H,34,37)