5-(4-fluorophenyl)-3-(phenylmethyl)-1,2,3-triazole-4-carbonitrile

Systemtic Name: 5-(4-fluorophenyl)-3-(phenylmethyl)-1,2,3-triazole-4-carbonitrile Openeye Name: 3-benzyl-5-(4-fluorophenyl)triazole-4-carbonitrile CAS Name: 5-(4-fluorophenyl)-3-(phenylmethyl)-4-triazolecarbonitrile IUPAC Name: 3-benzyl-5-(4-fluorophenyl)triazole-4-carbonitrile Traditional Name: 3-benzyl-5-(4-fluorophenyl)triazole-4-carbonitrile Formula: C16H11FN4 MolecularWeight: 278.283743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(N=N2)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(N=N2)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C16H11FN4/c17-14-8-6-13(7-9-14)16-15(10-18)21(20-19-16)11-12-4-2-1-3-5-12/h1-9H,11H2