6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]-5-(3-phenylpropyl)pyrimidin-4-amine

Systemtic Name: 6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]-5-(3-phenylpropyl)pyrimidin-4-amine Openeye Name: 6-[2-(6-morpholino-3-pyridyl)ethynyl]-5-(3-phenylpropyl)pyrimidin-4-amine CAS Name: 6-[2-[6-(4-morpholinyl)-3-pyridinyl]ethynyl]-5-(3-phenylpropyl)-4-pyrimidinamine IUPAC Name: 6-[2-(6-morpholin-4-ylpyridin-3-yl)ethynyl]-5-(3-phenylpropyl)pyrimidin-4-amine Traditional Name: [6-[2-(6-morpholino-3-pyridyl)ethynyl]-5-(3-phenylpropyl)pyrimidin-4-yl]amine Formula: C24H25N5O MolecularWeight: 399.4882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C#CC3=C(C(=NC=N3)N)CCCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C#CC3=C(C(=NC=N3)N)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H25N5O/c25-24-21(8-4-7-19-5-2-1-3-6-19)22(27-18-28-24)11-9-20-10-12-23(26-17-20)29-13-15-30-16-14-29/h1-3,5-6,10,12,17-18H,4,7-8,13-16H2,(H2,25,27,28)