(3S)-3-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one

Systemtic Name: (3S)-3-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one Openeye Name: (3S)-3-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylazepan-2-one CAS Name: (3S)-3-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-2-azepanone IUPAC Name: (3S)-3-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylazepan-2-one Traditional Name: (3S)-3-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]azepan-2-one Formula: C17H27N3OS MolecularWeight: 321.48078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC2CCCCNC2=O)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)S[C@H]2CCCCNC2=O)C3CCCCC3)C

InChI

InChI=1S/C17H27N3OS/c1-12-13(2)20(14-8-4-3-5-9-14)17(19-12)22-15-10-6-7-11-18-16(15)21/h14-15H,3-11H2,1-2H3,(H,18,21)/t15-/m0/s1