phenyl 3-[(4-cyclohexyl-1-methylsulfanyl-piperidin-4-yl)methyl]-4,4-dimethyl-2-oxidanylidene-imidazolidine-1-sulfonate

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanyl-piperidin-4-yl)methyl]-4,4-dimethyl-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanyl-4-piperidyl)methyl]-4,4-dimethyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(methylthio)-4-piperidinyl]methyl]-4,4-dimethyl-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanylpiperidin-4-yl)methyl]-4,4-dimethyl-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[[4-cyclohexyl-1-(methylthio)-4-piperidyl]methyl]-2-keto-4,4-dimethyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C24H37N3O4S2 MolecularWeight: 495.69828

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)SC)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)SC)C3CCCCC3)S(=O)(=O)OC4=CC=CC=C4)C

InChI

InChI=1S/C24H37N3O4S2/c1-23(2)18-27(33(29,30)31-21-12-8-5-9-13-21)22(28)26(23)19-24(20-10-6-4-7-11-20)14-16-25(32-3)17-15-24/h5,8-9,12-13,20H,4,6-7,10-11,14-19H2,1-3H3