ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[(phenylmethyl)amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[(phenylmethyl)amino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-(benzylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-[(phenylmethyl)amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-(benzylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CC=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCC2=CC=CC=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C19H21N5O2/c1-4-26-18(25)16-12-21-19(24-14(3)10-13(2)23-24)22-17(16)20-11-15-8-6-5-7-9-15/h5-10,12H,4,11H2,1-3H3,(H,20,21,22)