6-[(E)-2-[3,5-diphenyl-1-(2-phenylazanylpyrimidin-4-yl)pyrazol-4-yl]ethenyl]-4-oxidanyl-oxan-2-one

Systemtic Name: 6-[(E)-2-[3,5-diphenyl-1-(2-phenylazanylpyrimidin-4-yl)pyrazol-4-yl]ethenyl]-4-oxidanyl-oxan-2-one Openeye Name: 6-[(E)-2-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenyl-pyrazol-4-yl]vinyl]-4-hydroxy-tetrahydropyran-2-one CAS Name: 6-[(E)-2-[1-(2-anilino-4-pyrimidinyl)-3,5-diphenyl-4-pyrazolyl]ethenyl]-4-hydroxy-2-oxanone IUPAC Name: 6-[(E)-2-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenylpyrazol-4-yl]ethenyl]-4-hydroxyoxan-2-one Traditional Name: 6-[(E)-2-[1-(2-anilinopyrimidin-4-yl)-3,5-diphenyl-pyrazol-4-yl]vinyl]-4-hydroxy-tetrahydropyran-2-one Formula: C32H27N5O3 MolecularWeight: 529.58848

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)OC1C=CC2=C(N(N=C2C3=CC=CC=C3)C4=NC(=NC=C4)NC5=CC=CC=C5)C6=CC=CC=C6)O

Isomeric SMILES

C1C(CC(=O)OC1/C=C/C2=C(N(N=C2C3=CC=CC=C3)C4=NC(=NC=C4)NC5=CC=CC=C5)C6=CC=CC=C6)O

InChI

InChI=1S/C32H27N5O3/c38-25-20-26(40-29(39)21-25)16-17-27-30(22-10-4-1-5-11-22)36-37(31(27)23-12-6-2-7-13-23)28-18-19-33-32(35-28)34-24-14-8-3-9-15-24/h1-19,25-26,38H,20-21H2,(H,33,34,35)/b17-16+