2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile Formula: C18H16N4 MolecularWeight: 288.34644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=NN(C(=N1)C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H16N4/c1-13-20-14(2)22(21-13)12-15-7-9-16(10-8-15)18-6-4-3-5-17(18)11-19/h3-10H,12H2,1-2H3