ethyl 3-[2-(2-methyl-5-oxidanylidene-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)propanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(2-methyl-5-oxidanylidene-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)propanoylamino]benzoate Openeye Name: ethyl 3-[2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)propanoylamino]benzoate CAS Name: 3-[[2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)propanoylamino]benzoate Traditional Name: 3-[2-(5-keto-2-methyl-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)propanoylamino]benzoic acid ethyl ester Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N2C(=O)CCN3C2=CC(=N3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C(C)N2C(=O)CCN3C2=CC(=N3)C

InChI

InChI=1S/C19H22N4O4/c1-4-27-19(26)14-6-5-7-15(11-14)20-18(25)13(3)23-16-10-12(2)21-22(16)9-8-17(23)24/h5-7,10-11,13H,4,8-9H2,1-3H3,(H,20,25)