2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]pyridine-3-carbonitrile

Systemtic Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]pyridine-3-carbonitrile Openeye Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]pyridine-3-carbonitrile CAS Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methylamino]pyridine-3-carbonitrile Traditional Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)benzyl]amino]nicotinonitrile Formula: C16H14N6 MolecularWeight: 290.32256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCC2=CC=C(C=C2)CN3C=NC=N3)C#N

Isomeric SMILES

C1=CC(=C(N=C1)NCC2=CC=C(C=C2)CN3C=NC=N3)C#N

InChI

InChI=1S/C16H14N6/c17-8-15-2-1-7-19-16(15)20-9-13-3-5-14(6-4-13)10-22-12-18-11-21-22/h1-7,11-12H,9-10H2,(H,19,20)