3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]aniline

Systemtic Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]aniline Openeye Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]aniline CAS Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]aniline IUPAC Name: 3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]aniline Traditional Name: [3-[5-(4-tert-butylphenyl)-1H-1,2,4-triazol-3-yl]phenyl]amine Formula: C18H20N4 MolecularWeight: 292.3782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=NN2)C3=CC(=CC=C3)N

InChI

InChI=1S/C18H20N4/c1-18(2,3)14-9-7-12(8-10-14)16-20-17(22-21-16)13-5-4-6-15(19)11-13/h4-11H,19H2,1-3H3,(H,20,21,22)