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

Systemtic Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[[2-(4-methylpiperazin-1-yl)carbonylphenyl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(4-methylpiperazine-1-carbonyl)anilino]pyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-4-[2-[(4-methyl-1-piperazinyl)-oxomethyl]anilino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(4-methylpiperazine-1-carbonyl)anilino]pyrimidine-5-carboxylate Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-4-[2-(4-methylpiperazine-1-carbonyl)anilino]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H29N7O3 MolecularWeight: 463.53216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N3CCN(CC3)C)N4C(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC=C2C(=O)N3CCN(CC3)C)N4C(=CC(=N4)C)C

InChI

InChI=1S/C24H29N7O3/c1-5-34-23(33)19-15-25-24(31-17(3)14-16(2)28-31)27-21(19)26-20-9-7-6-8-18(20)22(32)30-12-10-29(4)11-13-30/h6-9,14-15H,5,10-13H2,1-4H3,(H,25,26,27)