2-[2-cyanoethyl-[2-(imidazol-1-ylmethyl)pyrimidin-4-yl]amino]-N,N-diethyl-ethanamide

Systemtic Name: 2-[2-cyanoethyl-[2-(imidazol-1-ylmethyl)pyrimidin-4-yl]amino]-N,N-diethyl-ethanamide Openeye Name: 2-[2-cyanoethyl-[2-(imidazol-1-ylmethyl)pyrimidin-4-yl]amino]-N,N-diethyl-acetamide CAS Name: 2-[2-cyanoethyl-[2-(1-imidazolylmethyl)-4-pyrimidinyl]amino]-N,N-diethylacetamide IUPAC Name: 2-[2-cyanoethyl-[2-(imidazol-1-ylmethyl)pyrimidin-4-yl]amino]-N,N-diethylacetamide Traditional Name: 2-[2-cyanoethyl-[2-(imidazol-1-ylmethyl)pyrimidin-4-yl]amino]-N,N-diethyl-acetamide Formula: C17H23N7O MolecularWeight: 341.41082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(CCC#N)C1=NC(=NC=C1)CN2C=CN=C2

Isomeric SMILES

CCN(CC)C(=O)CN(CCC#N)C1=NC(=NC=C1)CN2C=CN=C2

InChI

InChI=1S/C17H23N7O/c1-3-23(4-2)17(25)13-24(10-5-7-18)16-6-8-20-15(21-16)12-22-11-9-19-14-22/h6,8-9,11,14H,3-5,10,12-13H2,1-2H3