4-azanyl-3-[(4-tert-butylphenyl)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-azanyl-3-[(4-tert-butylphenyl)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(4-tert-butylphenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[(4-tert-butylphenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[(4-tert-butylphenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-(4-tert-butylbenzyl)-1H-1,2,4-triazole-5-thione Formula: C13H18N4S MolecularWeight: 262.37382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC2=NNC(=S)N2N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CC2=NNC(=S)N2N

InChI

InChI=1S/C13H18N4S/c1-13(2,3)10-6-4-9(5-7-10)8-11-15-16-12(18)17(11)14/h4-7H,8,14H2,1-3H3,(H,16,18)