4-[2-(1,2,4-triazol-1-yl)propan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(1,2,4-triazol-1-yl)propan-2-yl]benzenecarbonitrile Openeye Name: 4-[1-methyl-1-(1,2,4-triazol-1-yl)ethyl]benzonitrile CAS Name: 4-[2-(1,2,4-triazol-1-yl)propan-2-yl]benzonitrile IUPAC Name: 4-[2-(1,2,4-triazol-1-yl)propan-2-yl]benzonitrile Traditional Name: 4-[1-methyl-1-(1,2,4-triazol-1-yl)ethyl]benzonitrile Formula: C12H12N4 MolecularWeight: 212.25048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C#N)N2C=NC=N2

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C#N)N2C=NC=N2

InChI

InChI=1S/C12H12N4/c1-12(2,16-9-14-8-15-16)11-5-3-10(7-13)4-6-11/h3-6,8-9H,1-2H3