2-[(5-azanylquinolin-8-yl)methyl-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[(5-azanylquinolin-8-yl)methyl-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[(5-amino-8-quinolyl)methyl-(cyanomethyl)amino]acetonitrile CAS Name: 2-[(5-amino-8-quinolinyl)methyl-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[(5-aminoquinolin-8-yl)methyl-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[(5-amino-8-quinolyl)methyl-(cyanomethyl)amino]acetonitrile Formula: C14H13N5 MolecularWeight: 251.28652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)CN(CC#N)CC#N)N

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)CN(CC#N)CC#N)N

InChI

InChI=1S/C14H13N5/c15-5-8-19(9-6-16)10-11-3-4-13(17)12-2-1-7-18-14(11)12/h1-4,7H,8-10,17H2