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

Systemtic Name: ethyl 4-[(2-aminocarbonylphenyl)amino]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-carbamoylanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate CAS Name: 4-(2-carbamoylanilino)-2-(3,5-dimethyl-1-pyrazolyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-carbamoylanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-(2-carbamoylanilino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester Formula: C19H20N6O3 MolecularWeight: 380.4005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N)N3C(=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N)N3C(=CC(=N3)C)C

InChI

InChI=1S/C19H20N6O3/c1-4-28-18(27)14-10-21-19(25-12(3)9-11(2)24-25)23-17(14)22-15-8-6-5-7-13(15)16(20)26/h5-10H,4H2,1-3H3,(H2,20,26)(H,21,22,23)