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

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(phenylmethyl)piperidin-4-yl]methyl]-4-methyl-4-(2-methylpropyl)-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-4-isobutyl-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[[4-cyclohexyl-1-(phenylmethyl)-4-piperidinyl]methyl]-4-methyl-4-(2-methylpropyl)-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(1-benzyl-4-cyclohexylpiperidin-4-yl)methyl]-4-methyl-4-(2-methylpropyl)-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(1-benzyl-4-cyclohexyl-4-piperidyl)methyl]-4-isobutyl-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C33H47N3O4S MolecularWeight: 581.80898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

Isomeric SMILES

CC(C)CC1(CN(C(=O)N1CC2(CCN(CC2)CC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)OC5=CC=CC=C5)C

InChI

InChI=1S/C33H47N3O4S/c1-27(2)23-32(3)25-36(41(38,39)40-30-17-11-6-12-18-30)31(37)35(32)26-33(29-15-9-5-10-16-29)19-21-34(22-20-33)24-28-13-7-4-8-14-28/h4,6-8,11-14,17-18,27,29H,5,9-10,15-16,19-26H2,1-3H3