[3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 1-(4-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [3-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C28H24N4O4 MolecularWeight: 480.51456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=CC(=C3)NC4=NC=NC(=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OC3=CC=CC(=C3)NC4=NC=NC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H24N4O4/c1-35-23-12-10-22(11-13-23)32-17-20(14-27(32)33)28(34)36-24-9-5-8-21(15-24)31-26-16-25(29-18-30-26)19-6-3-2-4-7-19/h2-13,15-16,18,20H,14,17H2,1H3,(H,29,30,31)