N-[2-(butylamino)-5-cyano-pyrimidin-4-yl]benzamide

Systemtic Name: N-[2-(butylamino)-5-cyano-pyrimidin-4-yl]benzamide Openeye Name: N-[2-(butylamino)-5-cyano-pyrimidin-4-yl]benzamide CAS Name: N-[2-(butylamino)-5-cyano-4-pyrimidinyl]benzamide IUPAC Name: N-[2-(butylamino)-5-cyanopyrimidin-4-yl]benzamide Traditional Name: N-[2-(butylamino)-5-cyano-pyrimidin-4-yl]benzamide Formula: C16H17N5O MolecularWeight: 295.33908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC=C(C(=N1)NC(=O)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCNC1=NC=C(C(=N1)NC(=O)C2=CC=CC=C2)C#N

InChI

InChI=1S/C16H17N5O/c1-2-3-9-18-16-19-11-13(10-17)14(21-16)20-15(22)12-7-5-4-6-8-12/h4-8,11H,2-3,9H2,1H3,(H2,18,19,20,21,22)