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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanyl-piperidin-4-yl)methyl]-4-methyl-1-methylsulfanyl-2-oxidanylidene-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanyl-4-piperidyl)methyl]-4-methyl-1-methylsulfanyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(methylthio)-4-piperidinyl]methyl]-4-methyl-1-(methylthio)-2-oxo-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-methylsulfanylpiperidin-4-yl)methyl]-4-methyl-1-methylsulfanyl-2-oxoimidazolidine-4-sulfonate Traditional Name: 3-[[4-cyclohexyl-1-(methylthio)-4-piperidyl]methyl]-2-keto-4-methyl-1-(methylthio)imidazolidine-4-sulfonic acid phenyl ester Formula: C24H37N3O4S3 MolecularWeight: 527.76328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H37N3O4S3/c1-23(34(29,30)31-21-12-8-5-9-13-21)18-27(33-3)22(28)26(23)19-24(20-10-6-4-7-11-20)14-16-25(32-2)17-15-24/h5,8-9,12-13,20H,4,6-7,10-11,14-19H2,1-3H3