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

Systemtic Name: phenyl 4-cyclohexyl-4-[[5-methyl-5-(2-methylpropyl)-3-methylsulfanyl-2-oxidanylidene-imidazolidin-1-yl]methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-cyclohexyl-4-[(5-isobutyl-5-methyl-3-methylsulfanyl-2-oxo-imidazolidin-1-yl)methyl]piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5-methyl-5-(2-methylpropyl)-3-(methylthio)-2-oxo-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-cyclohexyl-4-[[5-methyl-5-(2-methylpropyl)-3-methylsulfanyl-2-oxoimidazolidin-1-yl]methyl]piperidine-1-sulfonate Traditional Name: 4-cyclohexyl-4-[[5-isobutyl-2-keto-5-methyl-3-(methylthio)imidazolidin-1-yl]methyl]piperidine-1-sulfonic acid phenyl ester Formula: C27H43N3O4S2 MolecularWeight: 537.77802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

Isomeric SMILES

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

InChI

InChI=1S/C27H43N3O4S2/c1-22(2)19-26(3)20-30(35-4)25(31)29(26)21-27(23-11-7-5-8-12-23)15-17-28(18-16-27)36(32,33)34-24-13-9-6-10-14-24/h6,9-10,13-14,22-23H,5,7-8,11-12,15-21H2,1-4H3