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

Systemtic Name: phenyl 3-[(4-cyclohexyl-1-propan-2-ylsulfonyl-piperidin-4-yl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxidanylidene-imidazolidine-1-sulfonate Openeye Name: phenyl 3-[(4-cyclohexyl-1-isopropylsulfonyl-4-piperidyl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxo-imidazolidine-1-sulfonate CAS Name: 3-[(4-cyclohexyl-1-propan-2-ylsulfonyl-4-piperidinyl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxo-1-imidazolidinesulfonic acid phenyl ester IUPAC Name: phenyl 3-[(4-cyclohexyl-1-propan-2-ylsulfonylpiperidin-4-yl)methyl]-4-(2-hydroxyphenyl)-4-methyl-2-oxoimidazolidine-1-sulfonate Traditional Name: 3-[(4-cyclohexyl-1-isopropylsulfonyl-4-piperidyl)methyl]-4-(2-hydroxyphenyl)-2-keto-4-methyl-imidazolidine-1-sulfonic acid phenyl ester Formula: C31H43N3O7S2 MolecularWeight: 633.81902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1CCC(CC1)(CN2C(=O)N(CC2(C)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC(C)S(=O)(=O)N1CCC(CC1)(CN2C(=O)N(CC2(C)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C31H43N3O7S2/c1-24(2)42(37,38)32-20-18-31(19-21-32,25-12-6-4-7-13-25)23-33-29(36)34(43(39,40)41-26-14-8-5-9-15-26)22-30(33,3)27-16-10-11-17-28(27)35/h5,8-11,14-17,24-25,35H,4,6-7,12-13,18-23H2,1-3H3