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

Systemtic Name: 2-[4-[(5-butyl-3-phenyl-1,2,4-triazol-1-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(5-butyl-3-phenyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(5-butyl-3-phenyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(5-butyl-3-phenyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(5-butyl-3-phenyl-1,2,4-triazol-1-yl)methyl]phenyl]benzonitrile Formula: C26H24N4 MolecularWeight: 392.49556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4/c1-2-3-13-25-28-26(22-9-5-4-6-10-22)29-30(25)19-20-14-16-21(17-15-20)24-12-8-7-11-23(24)18-27/h4-12,14-17H,2-3,13,19H2,1H3