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

Systemtic Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[2-(2-methylpiperidin-1-yl)carbonylphenyl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(2-methylpiperidine-1-carbonyl)anilino]pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-[2-[(2-methyl-1-piperidinyl)-oxomethyl]anilino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(2-methylpiperidine-1-carbonyl)anilino]pyrimidine-5-carboxylate Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(2-methylpiperidine-1-carbonyl)anilino]pyrimidine-5-carboxylic acid ethyl ester Formula: C25H30N6O3 MolecularWeight: 462.5441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N3CCCCC3C)N4C(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N3CCCCC3C)N4C(=CC(=N4)C)C

InChI

InChI=1S/C25H30N6O3/c1-5-34-24(33)20-15-26-25(31-18(4)14-16(2)29-31)28-22(20)27-21-12-7-6-11-19(21)23(32)30-13-9-8-10-17(30)3/h6-7,11-12,14-15,17H,5,8-10,13H2,1-4H3,(H,26,27,28)