7-[3,5-diphenyl-1-(2-phenylazanylpyrimidin-4-yl)pyrazol-4-yl]-2-ethyl-3,5-bis(oxidanyl)heptanoic acid

Systemtic Name: 7-[3,5-diphenyl-1-(2-phenylazanylpyrimidin-4-yl)pyrazol-4-yl]-2-ethyl-3,5-bis(oxidanyl)heptanoic acid Openeye Name: 7-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenyl-pyrazol-4-yl]-2-ethyl-3,5-dihydroxy-heptanoic acid CAS Name: 7-[1-(2-anilino-4-pyrimidinyl)-3,5-diphenyl-4-pyrazolyl]-2-ethyl-3,5-dihydroxyheptanoic acid IUPAC Name: 7-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenylpyrazol-4-yl]-2-ethyl-3,5-dihydroxyheptanoic acid Traditional Name: 7-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenyl-pyrazol-4-yl]-2-ethyl-3,5-dihydroxy-enanthic acid Formula: C34H35N5O4 MolecularWeight: 577.6728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(CCC1=C(N(N=C1C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC=CC=C4)C5=CC=CC=C5)O)O)C(=O)O

Isomeric SMILES

CCC(C(CC(CCC1=C(N(N=C1C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC=CC=C4)C5=CC=CC=C5)O)O)C(=O)O

InChI

InChI=1S/C34H35N5O4/c1-2-27(33(42)43)29(41)22-26(40)18-19-28-31(23-12-6-3-7-13-23)38-39(32(28)24-14-8-4-9-15-24)30-20-21-35-34(37-30)36-25-16-10-5-11-17-25/h3-17,20-21,26-27,29,40-41H,2,18-19,22H2,1H3,(H,42,43)(H,35,36,37)