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

Systemtic Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Openeye Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile CAS Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)-1-piperazinyl]-6-(2-hydroxyethylamino)-5-pyrimidinecarbonitrile IUPAC Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Traditional Name: 2-(cyclopropylamino)-4-[4-(4-fluorophenyl)piperazino]-6-(2-hydroxyethylamino)pyrimidine-5-carbonitrile Formula: C20H24FN7O MolecularWeight: 397.449263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=C(C(=N2)NCCO)C#N)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC1NC2=NC(=C(C(=N2)NCCO)C#N)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H24FN7O/c21-14-1-5-16(6-2-14)27-8-10-28(11-9-27)19-17(13-22)18(23-7-12-29)25-20(26-19)24-15-3-4-15/h1-2,5-6,15,29H,3-4,7-12H2,(H2,23,24,25,26)