4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide

Systemtic Name: 4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Openeye Name: 4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide CAS Name: 4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide IUPAC Name: 4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Traditional Name: 4-cyano-N-[3-(1,2,4-triazol-1-yl)propyl]benzamide Formula: C13H13N5O MolecularWeight: 255.27522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)NCCCN2C=NC=N2

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)NCCCN2C=NC=N2

InChI

InChI=1S/C13H13N5O/c14-8-11-2-4-12(5-3-11)13(19)16-6-1-7-18-10-15-9-17-18/h2-5,9-10H,1,6-7H2,(H,16,19)