4-(propylamino)benzenecarbonitrile; 1H-1,2,4-triazole

Systemtic Name: 4-(propylamino)benzenecarbonitrile; 1H-1,2,4-triazole Openeye Name: 4-(propylamino)benzonitrile; 1H-1,2,4-triazole CAS Name: 4-(propylamino)benzonitrile; 1H-1,2,4-triazole IUPAC Name: 4-(propylamino)benzonitrile; 1H-1,2,4-triazole Traditional Name: 4-(propylamino)benzonitrile; 1H-1,2,4-triazole Formula: C12H15N5 MolecularWeight: 229.281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=CC=C(C=C1)C#N.C1=NC=NN1

Isomeric SMILES

CCCNC1=CC=C(C=C1)C#N.C1=NC=NN1

InChI

InChI=1S/C10H12N2.C2H3N3/c1-2-7-12-10-5-3-9(8-11)4-6-10;1-3-2-5-4-1/h3-6,12H,2,7H2,1H3;1-2H,(H,3,4,5)