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

Systemtic Name: 2-(cyclopropylmethylamino)-4-[4-(4-fluorophenyl)piperidin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Openeye Name: 2-(cyclopropylmethylamino)-4-[4-(4-fluorophenyl)-1-piperidyl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile CAS Name: 2-(cyclopropylmethylamino)-4-[4-(4-fluorophenyl)-1-piperidinyl]-6-(2-hydroxyethylamino)-5-pyrimidinecarbonitrile IUPAC Name: 2-(cyclopropylmethylamino)-4-[4-(4-fluorophenyl)piperidin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Traditional Name: 2-(cyclopropylmethylamino)-4-[4-(4-fluorophenyl)piperidino]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Formula: C22H27FN6O MolecularWeight: 410.487783

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC(=C(C(=N2)NCCO)C#N)N3CCC(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1CNC2=NC(=C(C(=N2)NCCO)C#N)N3CCC(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H27FN6O/c23-18-5-3-16(4-6-18)17-7-10-29(11-8-17)21-19(13-24)20(25-9-12-30)27-22(28-21)26-14-15-1-2-15/h3-6,15,17,30H,1-2,7-12,14H2,(H2,25,26,27,28)