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

Systemtic Name: 2-[4-[(3-butyl-1-cyclopropyl-5-oxidanylidene-1,2,4-triazol-4-yl)methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[(3-butyl-1-cyclopropyl-5-oxo-1,2,4-triazol-4-yl)methyl]phenyl]benzonitrile CAS Name: 2-[4-[(3-butyl-1-cyclopropyl-5-oxo-1,2,4-triazol-4-yl)methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[(3-butyl-1-cyclopropyl-5-oxo-1,2,4-triazol-4-yl)methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(3-butyl-1-cyclopropyl-5-keto-1,2,4-triazol-4-yl)methyl]phenyl]benzonitrile Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C4CC4

Isomeric SMILES

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C4CC4

InChI

InChI=1S/C23H24N4O/c1-2-3-8-22-25-27(20-13-14-20)23(28)26(22)16-17-9-11-18(12-10-17)21-7-5-4-6-19(21)15-24/h4-7,9-12,20H,2-3,8,13-14,16H2,1H3