3-[(2-phenyl-1,2,3-triazol-4-yl)methylamino]benzenecarbonitrile

Systemtic Name: 3-[(2-phenyl-1,2,3-triazol-4-yl)methylamino]benzenecarbonitrile Openeye Name: 3-[(2-phenyltriazol-4-yl)methylamino]benzonitrile CAS Name: 3-[(2-phenyl-4-triazolyl)methylamino]benzonitrile IUPAC Name: 3-[(2-phenyltriazol-4-yl)methylamino]benzonitrile Traditional Name: 3-[(2-phenyltriazol-4-yl)methylamino]benzonitrile Formula: C16H13N5 MolecularWeight: 275.30792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=CC(=N2)CNC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2N=CC(=N2)CNC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H13N5/c17-10-13-5-4-6-14(9-13)18-11-15-12-19-21(20-15)16-7-2-1-3-8-16/h1-9,12,18H,11H2