2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-2,3-dihydroindol-5-yl)ethanone

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-2,3-dihydroindol-5-yl)ethanone Openeye Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonylindolin-5-yl)ethanone CAS Name: 2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-1-(1-methylsulfonyl-2,3-dihydroindol-5-yl)ethanone IUPAC Name: 2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-2,3-dihydroindol-5-yl)ethanone Traditional Name: 2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(1-mesylindolin-5-yl)ethanone Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)C4CCCCC4)C

InChI

InChI=1S/C22H29N3O3S2/c1-15-16(2)25(19-7-5-4-6-8-19)22(23-15)29-14-21(26)18-9-10-20-17(13-18)11-12-24(20)30(3,27)28/h9-10,13,19H,4-8,11-12,14H2,1-3H3