[3-[(6-methylpyrimidin-4-yl)amino]phenyl] 1,3-bis(oxidanylidene)-2-propan-2-yl-isoindole-5-carboxylate

Systemtic Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 1,3-bis(oxidanylidene)-2-propan-2-yl-isoindole-5-carboxylate Openeye Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 2-isopropyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-propan-2-yl-5-isoindolecarboxylic acid [3-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 1,3-dioxo-2-propan-2-ylisoindole-5-carboxylate Traditional Name: 2-isopropyl-1,3-diketo-isoindoline-5-carboxylic acid [3-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC(=CC=C2)OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C(C)C

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC(=CC=C2)OC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C(C)C

InChI

InChI=1S/C23H20N4O4/c1-13(2)27-21(28)18-8-7-15(10-19(18)22(27)29)23(30)31-17-6-4-5-16(11-17)26-20-9-14(3)24-12-25-20/h4-13H,1-3H3,(H,24,25,26)