N-[4-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]phenyl]propanamide IUPAC Name: N-[4-[2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]acetyl]phenyl]propionamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=C(N2C3CCCCC3)C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC(=C(N2C3CCCCC3)C)C

InChI

InChI=1S/C22H29N3O2S/c1-4-21(27)24-18-12-10-17(11-13-18)20(26)14-28-22-23-15(2)16(3)25(22)19-8-6-5-7-9-19/h10-13,19H,4-9,14H2,1-3H3,(H,24,27)