2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperidin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile

Systemtic Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperidin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Openeye Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)-1-piperidyl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile CAS Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)-1-piperidinyl]-6-(2-hydroxyethylamino)-5-pyrimidinecarbonitrile IUPAC Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperidin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Traditional Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperidino]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Formula: C21H25FN6O MolecularWeight: 396.461203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=C(C(=N2)NCCO)C#N)N3CCC(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1NC2=NC(=C(C(=N2)NCCO)C#N)N3CCC(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H25FN6O/c22-16-3-1-14(2-4-16)15-7-10-28(11-8-15)20-18(13-23)19(24-9-12-29)26-21(27-20)25-17-5-6-17/h1-4,15,17,29H,5-12H2,(H2,24,25,26,27)