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

Systemtic Name: phenyl 3-[[4-cyclohexyl-1-(phenylsulfonyl)piperidin-4-yl]methyl]-1-ethoxy-4-methyl-2-oxidanylidene-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[[1-(benzenesulfonyl)-4-cyclohexyl-4-piperidyl]methyl]-1-ethoxy-4-methyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 3-[[1-(benzenesulfonyl)-4-cyclohexyl-4-piperidinyl]methyl]-1-ethoxy-4-methyl-2-oxo-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[[1-(benzenesulfonyl)-4-cyclohexylpiperidin-4-yl]methyl]-1-ethoxy-4-methyl-2-oxoimidazolidine-4-sulfonate Traditional Name: 3-[(1-besyl-4-cyclohexyl-4-piperidyl)methyl]-1-ethoxy-2-keto-4-methyl-imidazolidine-4-sulfonic acid phenyl ester Formula: C30H41N3O7S2 MolecularWeight: 619.79244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON1CC(N(C1=O)CC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)(C)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

CCON1CC(N(C1=O)CC2(CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4CCCCC4)(C)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C30H41N3O7S2/c1-3-39-33-23-29(2,42(37,38)40-26-15-9-5-10-16-26)32(28(33)34)24-30(25-13-7-4-8-14-25)19-21-31(22-20-30)41(35,36)27-17-11-6-12-18-27/h5-6,9-12,15-18,25H,3-4,7-8,13-14,19-24H2,1-2H3