3-[[5-azanyl-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[[5-azanyl-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[[5-amino-6-(tetrahydrofuran-2-ylmethylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[5-amino-6-(2-oxolanylmethylamino)-4-pyrimidinyl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[[5-amino-6-(oxolan-2-ylmethylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[[5-amino-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propionitrile Formula: C15H21N7O MolecularWeight: 315.37354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=C(C(=NC=N2)N(CCC#N)CCC#N)N

Isomeric SMILES

C1CC(OC1)CNC2=C(C(=NC=N2)N(CCC#N)CCC#N)N

InChI

InChI=1S/C15H21N7O/c16-5-2-7-22(8-3-6-17)15-13(18)14(20-11-21-15)19-10-12-4-1-9-23-12/h11-12H,1-4,7-10,18H2,(H,19,20,21)