N5-methyl-6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]-N5-(phenylmethyl)pyrimidine-4,5-diamine

Systemtic Name: N5-methyl-6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]-N5-(phenylmethyl)pyrimidine-4,5-diamine Openeye Name: N5-benzyl-N5-methyl-6-[2-(6-morpholino-3-pyridyl)ethynyl]pyrimidine-4,5-diamine CAS Name: N5-methyl-6-[2-[6-(4-morpholinyl)-3-pyridinyl]ethynyl]-N5-(phenylmethyl)pyrimidine-4,5-diamine IUPAC Name: 5-N-benzyl-5-N-methyl-6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]pyrimidine-4,5-diamine Traditional Name: [4-amino-6-[2-(6-morpholino-3-pyridyl)ethynyl]pyrimidin-5-yl]-benzyl-methyl-amine Formula: C23H24N6O MolecularWeight: 400.47626

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=C(N=CN=C2N)C#CC3=CN=C(C=C3)N4CCOCC4

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=C(N=CN=C2N)C#CC3=CN=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H24N6O/c1-28(16-19-5-3-2-4-6-19)22-20(26-17-27-23(22)24)9-7-18-8-10-21(25-15-18)29-11-13-30-14-12-29/h2-6,8,10,15,17H,11-14,16H2,1H3,(H2,24,26,27)