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

Systemtic Name: N-[4-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylacetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylacetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]acetyl]phenyl]methanesulfonamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C3CCCCC3)C

InChI

InChI=1S/C20H27N3O3S2/c1-14-15(2)23(18-7-5-4-6-8-18)20(21-14)27-13-19(24)16-9-11-17(12-10-16)22-28(3,25)26/h9-12,18,22H,4-8,13H2,1-3H3