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

Systemtic Name: 2-[4-[(3,5-dibutyl-1,3-dihydro-1,2,4-triazol-2-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(3,5-dibutyl-1,3-dihydro-1,2,4-triazol-2-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(3,5-dibutyl-1,3-dihydro-1,2,4-triazol-2-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(3,5-dibutyl-1,3-dihydro-1,2,4-triazol-2-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(3,5-dibutyl-1,3-dihydro-1,2,4-triazol-2-yl)methyl]phenyl]benzonitrile Formula: C24H30N4 MolecularWeight: 374.5218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N=C(NN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CCCC

Isomeric SMILES

CCCCC1N=C(NN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CCCC

InChI

InChI=1S/C24H30N4/c1-3-5-11-23-26-24(12-6-4-2)28(27-23)18-19-13-15-20(16-14-19)22-10-8-7-9-21(22)17-25/h7-10,13-16,24H,3-6,11-12,18H2,1-2H3,(H,26,27)