4-azanyl-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-azanyl-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-amino-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-amino-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-amino-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-amino-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Formula: C12H15N4S- MolecularWeight: 247.3393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)[S-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N)[S-]

InChI

InChI=1S/C12H16N4S/c1-12(2,3)9-6-4-8(5-7-9)10-14-15-11(17)16(10)13/h4-7H,13H2,1-3H3,(H,15,17)/p-1