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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-iodanyl-piperidin-4-yl)methyl]-4-methyl-2-oxidanylidene-1-propan-2-ylsulfonyl-imidazolidine-4-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-iodo-4-piperidyl)methyl]-1-isopropylsulfonyl-4-methyl-2-oxo-imidazolidine-4-sulfonate CAS Name: 3-[(4-cyclohexyl-1-iodo-4-piperidinyl)methyl]-4-methyl-2-oxo-1-propan-2-ylsulfonyl-4-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-iodopiperidin-4-yl)methyl]-4-methyl-2-oxo-1-propan-2-ylsulfonylimidazolidine-4-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-iodo-4-piperidyl)methyl]-1-isopropylsulfonyl-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)N1CC(N(C1=O)CC2(CCN(CC2)I)C3CCCCC3)(C)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)N1CC(N(C1=O)CC2(CCN(CC2)I)C3CCCCC3)(C)S(=O)(=O)OC4=CC=CC=C4

InChI

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