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

Systemtic Name: 3-(4-tert-butylphenyl)-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-tert-butylphenyl)-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-tert-butylphenyl)-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-tert-butylphenyl)-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-tert-butylphenyl)-4-methyl-1H-1,2,4-triazole-5-thione Formula: C13H17N3S MolecularWeight: 247.35918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2C

InChI

InChI=1S/C13H17N3S/c1-13(2,3)10-7-5-9(6-8-10)11-14-15-12(17)16(11)4/h5-8H,1-4H3,(H,15,17)