ethyl 5,7-dimethyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 5,7-dimethyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 6-benzyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5,7-dimethyl-6-(phenylmethyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-benzyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-benzyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C18H19N3O2 MolecularWeight: 309.36236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N=C(C(=C(N2N=C1)C)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C2N=C(C(=C(N2N=C1)C)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H19N3O2/c1-4-23-18(22)16-11-19-21-13(3)15(12(2)20-17(16)21)10-14-8-6-5-7-9-14/h5-9,11H,4,10H2,1-3H3