2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)pyrimidine-5-carbonitrile

Systemtic Name: 2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)pyrimidine-5-carbonitrile Openeye Name: 2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenyl-1-piperidyl)pyrimidine-5-carbonitrile CAS Name: 2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenyl-1-piperidinyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenylpiperidin-1-yl)pyrimidine-5-carbonitrile Traditional Name: 2-(cyclopropylamino)-4-(2-hydroxyethylamino)-6-(4-phenylpiperidino)pyrimidine-5-carbonitrile Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N6O/c22-14-18-19(23-10-13-28)25-21(24-17-6-7-17)26-20(18)27-11-8-16(9-12-27)15-4-2-1-3-5-15/h1-5,16-17,28H,6-13H2,(H2,23,24,25,26)