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

Systemtic Name: phenyl 4-cyclohexyl-4-[(5-methyl-3-methylsulfanyl-2-oxidanylidene-5-propan-2-ylsulfonyl-imidazolidin-1-yl)methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-cyclohexyl-4-[(5-isopropylsulfonyl-5-methyl-3-methylsulfanyl-2-oxo-imidazolidin-1-yl)methyl]piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5-methyl-3-(methylthio)-2-oxo-5-propan-2-ylsulfonyl-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-cyclohexyl-4-[(5-methyl-3-methylsulfanyl-2-oxo-5-propan-2-ylsulfonylimidazolidin-1-yl)methyl]piperidine-1-sulfonate Traditional Name: 4-cyclohexyl-4-[[5-isopropylsulfonyl-2-keto-5-methyl-3-(methylthio)imidazolidin-1-yl]methyl]piperidine-1-sulfonic acid phenyl ester Formula: C26H41N3O6S3 MolecularWeight: 587.81524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

Isomeric SMILES

CC(C)S(=O)(=O)C1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)SC)C

InChI

InChI=1S/C26H41N3O6S3/c1-21(2)37(31,32)25(3)19-29(36-4)24(30)28(25)20-26(22-11-7-5-8-12-22)15-17-27(18-16-26)38(33,34)35-23-13-9-6-10-14-23/h6,9-10,13-14,21-22H,5,7-8,11-12,15-20H2,1-4H3