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

Systemtic Name: phenyl 4-cyclohexyl-4-[[5-methyl-2-oxidanylidene-3-(phenylmethyl)-5-propyl-imidazolidin-1-yl]methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-[(3-benzyl-5-methyl-2-oxo-5-propyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonate CAS Name: 4-cyclohexyl-4-[[5-methyl-2-oxo-3-(phenylmethyl)-5-propyl-1-imidazolidinyl]methyl]-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[(3-benzyl-5-methyl-2-oxo-5-propylimidazolidin-1-yl)methyl]-4-cyclohexylpiperidine-1-sulfonate Traditional Name: 4-[(3-benzyl-2-keto-5-methyl-5-propyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonic acid phenyl ester Formula: C32H45N3O4S MolecularWeight: 567.7824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C

Isomeric SMILES

CCCC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)CC5=CC=CC=C5)C

InChI

InChI=1S/C32H45N3O4S/c1-3-19-31(2)25-33(24-27-13-7-4-8-14-27)30(36)35(31)26-32(28-15-9-5-10-16-28)20-22-34(23-21-32)40(37,38)39-29-17-11-6-12-18-29/h4,6-8,11-14,17-18,28H,3,5,9-10,15-16,19-26H2,1-2H3