4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)-2-(pyridin-3-ylmethylamino)pyrimidine-5-carbonitrile

Systemtic Name: 4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)-2-(pyridin-3-ylmethylamino)pyrimidine-5-carbonitrile Openeye Name: 4-(2-hydroxyethylamino)-6-(4-phenyl-1-piperidyl)-2-(3-pyridylmethylamino)pyrimidine-5-carbonitrile CAS Name: 4-(2-hydroxyethylamino)-6-(4-phenyl-1-piperidinyl)-2-(3-pyridinylmethylamino)-5-pyrimidinecarbonitrile IUPAC Name: 4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)-2-(pyridin-3-ylmethylamino)pyrimidine-5-carbonitrile Traditional Name: 4-(2-hydroxyethylamino)-6-(4-phenylpiperidino)-2-(3-pyridylmethylamino)pyrimidine-5-carbonitrile Formula: C24H27N7O MolecularWeight: 429.51748

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=C2)C3=C(C(=NC(=N3)NCC4=CN=CC=C4)NCCO)C#N

Isomeric SMILES

C1CN(CCC1C2=CC=CC=C2)C3=C(C(=NC(=N3)NCC4=CN=CC=C4)NCCO)C#N

InChI

InChI=1S/C24H27N7O/c25-15-21-22(27-11-14-32)29-24(28-17-18-5-4-10-26-16-18)30-23(21)31-12-8-20(9-13-31)19-6-2-1-3-7-19/h1-7,10,16,20,32H,8-9,11-14,17H2,(H2,27,28,29,30)