ethyl 4-[(3-methyl-5-oxidanylidene-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-methyl-5-oxidanylidene-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(3-methyl-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl)amino]benzoate CAS Name: 4-[[(3-methyl-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-methyl-5-oxo-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl)amino]benzoate Traditional Name: 4-[(5-keto-3-methyl-2-phenyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl)amino]benzoic acid ethyl ester Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N=C3N2NC(=C3C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N=C3N2NC(=C3C)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O4/c1-3-31-23(30)16-9-11-17(12-10-16)24-22(29)18-13-19(28)25-21-14(2)20(26-27(18)21)15-7-5-4-6-8-15/h4-12,18,26H,3,13H2,1-2H3,(H,24,29)