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

Systemtic Name: phenyl 4-cyclohexyl-4-[[5-methyl-2-oxidanylidene-5-phenyl-3-(phenylmethyl)imidazolidin-1-yl]methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-[(3-benzyl-5-methyl-2-oxo-5-phenyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5-methyl-2-oxo-5-phenyl-3-(phenylmethyl)-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[(3-benzyl-5-methyl-2-oxo-5-phenylimidazolidin-1-yl)methyl]-4-cyclohexylpiperidine-1-sulfonate Traditional Name: 4-[(3-benzyl-2-keto-5-methyl-5-phenyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonic acid phenyl ester Formula: C35H43N3O4S MolecularWeight: 601.79862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H43N3O4S/c1-34(30-16-8-3-9-17-30)27-36(26-29-14-6-2-7-15-29)33(39)38(34)28-35(31-18-10-4-11-19-31)22-24-37(25-23-35)43(40,41)42-32-20-12-5-13-21-32/h2-3,5-9,12-17,20-21,31H,4,10-11,18-19,22-28H2,1H3