4-(5-azanylbenzotriazol-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-azanylbenzotriazol-2-yl)benzenecarbonitrile Openeye Name: 4-(5-aminobenzotriazol-2-yl)benzonitrile CAS Name: 4-(5-amino-2-benzotriazolyl)benzonitrile IUPAC Name: 4-(5-aminobenzotriazol-2-yl)benzonitrile Traditional Name: 4-(5-aminobenzotriazol-2-yl)benzonitrile Formula: C13H9N5 MolecularWeight: 235.24406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N2N=C3C=CC(=CC3=N2)N

Isomeric SMILES

C1=CC(=CC=C1C#N)N2N=C3C=CC(=CC3=N2)N

InChI

InChI=1S/C13H9N5/c14-8-9-1-4-11(5-2-9)18-16-12-6-3-10(15)7-13(12)17-18/h1-7H,15H2