2-(3-morpholin-4-ylpropylamino)-2-pyrimidin-4-yl-ethanenitrile

Systemtic Name: 2-(3-morpholin-4-ylpropylamino)-2-pyrimidin-4-yl-ethanenitrile Openeye Name: 2-(3-morpholinopropylamino)-2-pyrimidin-4-yl-acetonitrile CAS Name: 2-[3-(4-morpholinyl)propylamino]-2-(4-pyrimidinyl)acetonitrile IUPAC Name: 2-(3-morpholin-4-ylpropylamino)-2-pyrimidin-4-ylacetonitrile Traditional Name: 2-(3-morpholinopropylamino)-2-(4-pyrimidyl)acetonitrile Formula: C13H19N5O MolecularWeight: 261.32286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(C#N)C2=NC=NC=C2

Isomeric SMILES

C1COCCN1CCCNC(C#N)C2=NC=NC=C2

InChI

InChI=1S/C13H19N5O/c14-10-13(12-2-4-15-11-17-12)16-3-1-5-18-6-8-19-9-7-18/h2,4,11,13,16H,1,3,5-9H2