[1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: [1-methyl-2-oxo-2-(pyrimidin-2-ylamino)ethyl] 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid [1-oxo-1-(2-pyrimidinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyrimidin-2-ylamino)propan-2-yl] 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid [2-keto-1-methyl-2-(2-pyrimidylamino)ethyl] ester Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC(C)C(=O)NC3=NC=CC=N3

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC(C)C(=O)NC3=NC=CC=N3

InChI

InChI=1S/C19H19N5O4/c1-3-11-24-17(26)14-8-5-4-7-13(14)15(23-24)18(27)28-12(2)16(25)22-19-20-9-6-10-21-19/h4-10,12H,3,11H2,1-2H3,(H,20,21,22,25)