ethyl 4-(cyclopentylamino)-2-[(5-piperidin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(cyclopentylamino)-2-[(5-piperidin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-(cyclopentylamino)-2-[[5-(1-piperidyl)-2-pyridyl]amino]pyrimidine-5-carboxylate CAS Name: 4-(cyclopentylamino)-2-[[5-(1-piperidinyl)-2-pyridinyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopentylamino)-2-[(5-piperidin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate Traditional Name: 4-(cyclopentylamino)-2-[(5-piperidino-2-pyridyl)amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2CCCC2)NC3=NC=C(C=C3)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2CCCC2)NC3=NC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H30N6O2/c1-2-30-21(29)18-15-24-22(27-20(18)25-16-8-4-5-9-16)26-19-11-10-17(14-23-19)28-12-6-3-7-13-28/h10-11,14-16H,2-9,12-13H2,1H3,(H2,23,24,25,26,27)