phenyl 4-cyclohexyl-4-[(5-ethyl-5-methyl-3-methylsulfanyl-2-oxidanylidene-imidazolidin-1-yl)methyl]piperidine-1-sulfonate

Systemtic Name: phenyl 4-cyclohexyl-4-[(5-ethyl-5-methyl-3-methylsulfanyl-2-oxidanylidene-imidazolidin-1-yl)methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-cyclohexyl-4-[(5-ethyl-5-methyl-3-methylsulfanyl-2-oxo-imidazolidin-1-yl)methyl]piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5-ethyl-5-methyl-3-(methylthio)-2-oxo-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-cyclohexyl-4-[(5-ethyl-5-methyl-3-methylsulfanyl-2-oxoimidazolidin-1-yl)methyl]piperidine-1-sulfonate Traditional Name: 4-cyclohexyl-4-[[5-ethyl-2-keto-5-methyl-3-(methylthio)imidazolidin-1-yl]methyl]piperidine-1-sulfonic acid phenyl ester Formula: C25H39N3O4S2 MolecularWeight: 509.72486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

Isomeric SMILES

CCC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

InChI

InChI=1S/C25H39N3O4S2/c1-4-24(2)19-28(33-3)23(29)27(24)20-25(21-11-7-5-8-12-21)15-17-26(18-16-25)34(30,31)32-22-13-9-6-10-14-22/h6,9-10,13-14,21H,4-5,7-8,11-12,15-20H2,1-3H3