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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=NNC(=S)N1C2=CC=C(C=C2)C(C)(C)C

InChI

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