2-[(5-azanylquinolin-6-yl)-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[(5-azanylquinolin-6-yl)-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[(5-amino-6-quinolyl)-(cyanomethyl)amino]acetonitrile CAS Name: 2-[(5-amino-6-quinolinyl)-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[(5-aminoquinolin-6-yl)-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[(5-amino-6-quinolyl)-(cyanomethyl)amino]acetonitrile Formula: C13H11N5 MolecularWeight: 237.25994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N5/c14-5-8-18(9-6-15)12-4-3-11-10(13(12)16)2-1-7-17-11/h1-4,7H,8-9,16H2