phenyl 3-[(4-cyclohexyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]-1-iodanyl-4-methyl-2-oxidanylidene-imidazolidine-4-sulfonate

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]-1-iodanyl-4-methyl-2-oxidanylidene-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-isopropylsulfonyl-4-piperidyl)methyl]-1-iodo-4-methyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 3-[(4-cyclohexyl-1-propan-2-ylsulfonyl-4-piperidinyl)methyl]-1-iodo-4-methyl-2-oxo-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-propan-2-ylsulfonylpiperidin-4-yl)methyl]-1-iodo-4-methyl-2-oxoimidazolidine-4-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-isopropylsulfonyl-4-piperidyl)methyl]-1-iodo-2-keto-4-methyl-imidazolidine-4-sulfonic acid phenyl ester Formula: C25H38IN3O6S2 MolecularWeight: 667.62019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)(CN2C(=O)N(CC2(C)S(=O)(=O)OC3=CC=CC=C3)I)C4CCCCC4

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)(CN2C(=O)N(CC2(C)S(=O)(=O)OC3=CC=CC=C3)I)C4CCCCC4

InChI

InChI=1S/C25H38IN3O6S2/c1-20(2)36(31,32)27-16-14-25(15-17-27,21-10-6-4-7-11-21)19-28-23(30)29(26)18-24(28,3)37(33,34)35-22-12-8-5-9-13-22/h5,8-9,12-13,20-21H,4,6-7,10-11,14-19H2,1-3H3