3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Openeye Name: 3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Traditional Name: 3-(4-tert-butylphenyl)-5-(1,2,4-triazol-1-ylmethyl)-1H-1,2,4-triazole Formula: C15H18N6 MolecularWeight: 282.34362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=N2)CN3C=NC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=N2)CN3C=NC=N3

InChI

InChI=1S/C15H18N6/c1-15(2,3)12-6-4-11(5-7-12)14-18-13(19-20-14)8-21-10-16-9-17-21/h4-7,9-10H,8H2,1-3H3,(H,18,19,20)