1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-(4-tert-butyl-2,6-dimethyl-benzyl)-1,2,4-triazole-3-carbonitrile Formula: C16H20N4 MolecularWeight: 268.3568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CN2C=NC(=N2)C#N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CN2C=NC(=N2)C#N)C)C(C)(C)C

InChI

InChI=1S/C16H20N4/c1-11-6-13(16(3,4)5)7-12(2)14(11)9-20-10-18-15(8-17)19-20/h6-7,10H,9H2,1-5H3