(3R,5R)-7-[5-(4-fluorophenyl)-2-(phenylmethyl)sulfonyl-3-propan-2-yl-imidazol-4-yl]-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: (3R,5R)-7-[5-(4-fluorophenyl)-2-(phenylmethyl)sulfonyl-3-propan-2-yl-imidazol-4-yl]-3,5-bis(oxidanyl)heptanoic acid Openeye Name: (3R,5R)-7-[2-benzylsulfonyl-5-(4-fluorophenyl)-3-isopropyl-imidazol-4-yl]-3,5-dihydroxy-heptanoic acid CAS Name: (3R,5R)-7-[5-(4-fluorophenyl)-2-(phenylmethyl)sulfonyl-3-propan-2-yl-4-imidazolyl]-3,5-dihydroxyheptanoic acid IUPAC Name: (3R,5R)-7-[2-benzylsulfonyl-5-(4-fluorophenyl)-3-propan-2-ylimidazol-4-yl]-3,5-dihydroxyheptanoic acid Traditional Name: (3R,5R)-7-[2-benzylsulfonyl-5-(4-fluorophenyl)-3-isopropyl-imidazol-4-yl]-3,5-dihydroxy-enanthic acid Formula: C26H31FN2O6S MolecularWeight: 518.597543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(N=C1S(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)F)CCC(CC(CC(=O)O)O)O

Isomeric SMILES

CC(C)N1C(=C(N=C1S(=O)(=O)CC2=CC=CC=C2)C3=CC=C(C=C3)F)CC[C@H](C[C@H](CC(=O)O)O)O

InChI

InChI=1S/C26H31FN2O6S/c1-17(2)29-23(13-12-21(30)14-22(31)15-24(32)33)25(19-8-10-20(27)11-9-19)28-26(29)36(34,35)16-18-6-4-3-5-7-18/h3-11,17,21-22,30-31H,12-16H2,1-2H3,(H,32,33)/t21-,22-/m1/s1