diethyl 2-[(7-phenylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]propanedioate

Systemtic Name: diethyl 2-[(7-phenylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]propanedioate Openeye Name: diethyl 2-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]propanedioate CAS Name: 2-[[oxo-(7-phenyl-3-pyrazolo[1,5-a]pyrimidinyl)methyl]amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]propanedioate Traditional Name: 2-[(7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]malonic acid diethyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=O)C1=C2N=CC=C(N2N=C1)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=O)C1=C2N=CC=C(N2N=C1)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O5/c1-3-28-19(26)16(20(27)29-4-2)23-18(25)14-12-22-24-15(10-11-21-17(14)24)13-8-6-5-7-9-13/h5-12,16H,3-4H2,1-2H3,(H,23,25)