ethyl 4-[4-acetamido-2-(piperidin-1-ylmethyl)phenoxy]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[4-acetamido-2-(piperidin-1-ylmethyl)phenoxy]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-acetamido-2-(1-piperidylmethyl)phenoxy]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate CAS Name: 4-[4-acetamido-2-(1-piperidinylmethyl)phenoxy]-2-(3,5-dimethyl-1-pyrazolyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-acetamido-2-(piperidin-1-ylmethyl)phenoxy]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-[4-acetamido-2-(piperidinomethyl)phenoxy]-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester Formula: C26H32N6O4 MolecularWeight: 492.57008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1OC2=C(C=C(C=C2)NC(=O)C)CN3CCCCC3)N4C(=CC(=N4)C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1OC2=C(C=C(C=C2)NC(=O)C)CN3CCCCC3)N4C(=CC(=N4)C)C

InChI

InChI=1S/C26H32N6O4/c1-5-35-25(34)22-15-27-26(32-18(3)13-17(2)30-32)29-24(22)36-23-10-9-21(28-19(4)33)14-20(23)16-31-11-7-6-8-12-31/h9-10,13-15H,5-8,11-12,16H2,1-4H3,(H,28,33)