2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3,4-dimethoxyphenyl)propanamide

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3,4-dimethoxyphenyl)propanamide Openeye Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3,4-dimethoxyphenyl)propanamide CAS Name: 2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: 2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: 2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(3,4-dimethoxyphenyl)propionamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC(=C(C=C2)OC)OC)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SC(C)C(=O)NC2=CC(=C(C=C2)OC)OC)C3CCCCC3)C

InChI

InChI=1S/C22H31N3O3S/c1-14-15(2)25(18-9-7-6-8-10-18)22(23-14)29-16(3)21(26)24-17-11-12-19(27-4)20(13-17)28-5/h11-13,16,18H,6-10H2,1-5H3,(H,24,26)