[1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(pyrimidin-2-ylamino)ethyl] 2-benzyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxylic acid [1-oxo-1-(2-pyrimidinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyrimidin-2-ylamino)propan-2-yl] 2-benzyl-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-benzyl-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-1-methyl-2-(2-pyrimidylamino)ethyl] ester Formula: C23H18N4O5 MolecularWeight: 430.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CC=N1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC=CC=N1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H18N4O5/c1-14(19(28)26-23-24-10-5-11-25-23)32-22(31)16-8-9-17-18(12-16)21(30)27(20(17)29)13-15-6-3-2-4-7-15/h2-12,14H,13H2,1H3,(H,24,25,26,28)