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

Systemtic Name: phenyl 4-cyclohexyl-4-[[5-methyl-2-oxidanylidene-5-phenoxysulfonyl-3-(phenylsulfonyl)imidazolidin-1-yl]methyl]piperidine-1-sulfonate Openeye Name: phenyl 4-[[3-(benzenesulfonyl)-5-methyl-2-oxo-5-phenoxysulfonyl-imidazolidin-1-yl]methyl]-4-cyclohexyl-piperidine-1-sulfonate CAS Name: 4-[[3-(benzenesulfonyl)-5-methyl-2-oxo-5-phenoxysulfonyl-1-imidazolidinyl]methyl]-4-cyclohexyl-1-piperidinesulfonic acid phenyl ester IUPAC Name: phenyl 4-[[3-(benzenesulfonyl)-5-methyl-2-oxo-5-phenoxysulfonylimidazolidin-1-yl]methyl]-4-cyclohexylpiperidine-1-sulfonate Traditional Name: 4-[(3-besyl-2-keto-5-methyl-5-phenoxysulfonyl-imidazolidin-1-yl)methyl]-4-cyclohexyl-piperidine-1-sulfonic acid phenyl ester Formula: C34H41N3O9S3 MolecularWeight: 731.89904

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

Isomeric SMILES

CC1(CN(C(=O)N1CC2(CCN(CC2)S(=O)(=O)OC3=CC=CC=C3)C4CCCCC4)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

InChI

InChI=1S/C34H41N3O9S3/c1-33(48(41,42)45-29-16-8-3-9-17-29)26-37(47(39,40)31-20-12-5-13-21-31)32(38)36(33)27-34(28-14-6-2-7-15-28)22-24-35(25-23-34)49(43,44)46-30-18-10-4-11-19-30/h3-5,8-13,16-21,28H,2,6-7,14-15,22-27H2,1H3