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

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(phenylsulfonyl)piperidin-4-yl]methyl]-4-methyl-4-(2-methylpropyl)-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[[1-(benzenesulfonyl)-4-cyclohexyl-4-piperidyl]methyl]-4-isobutyl-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[[1-(benzenesulfonyl)-4-cyclohexyl-4-piperidinyl]methyl]-4-methyl-4-(2-methylpropyl)-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[[1-(benzenesulfonyl)-4-cyclohexylpiperidin-4-yl]methyl]-4-methyl-4-(2-methylpropyl)-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(1-besyl-4-cyclohexyl-4-piperidyl)methyl]-4-isobutyl-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C32H45N3O6S2 MolecularWeight: 631.8462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

Isomeric SMILES

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

InChI

InChI=1S/C32H45N3O6S2/c1-26(2)23-31(3)24-35(43(39,40)41-28-15-9-5-10-16-28)30(36)34(31)25-32(27-13-7-4-8-14-27)19-21-33(22-20-32)42(37,38)29-17-11-6-12-18-29/h5-6,9-12,15-18,26-27H,4,7-8,13-14,19-25H2,1-3H3