methyl 5-methyl-6-[(4-methylphenyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: methyl 5-methyl-6-[(4-methylphenyl)methyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: methyl 5-methyl-7-oxo-6-(p-tolylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5-methyl-6-[(4-methylphenyl)methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-6-[(4-methylphenyl)methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-keto-5-methyl-6-(4-methylbenzyl)-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(N=C3C(=CNN3C2=O)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(N=C3C(=CNN3C2=O)C(=O)OC)C

InChI

InChI=1S/C17H17N3O3/c1-10-4-6-12(7-5-10)8-13-11(2)19-15-14(17(22)23-3)9-18-20(15)16(13)21/h4-7,9,18H,8H2,1-3H3