4-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 4-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-triazole-3-thiolate Openeye Name: 4-methyl-5-(p-tolylsulfanylmethyl)-1,2,4-triazole-3-thiolate CAS Name: 4-methyl-5-[[(4-methylphenyl)thio]methyl]-1,2,4-triazole-3-thiolate IUPAC Name: 4-methyl-5-[(4-methylphenyl)sulfanylmethyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-methyl-5-[(p-tolylthio)methyl]-1,2,4-triazole-3-thiolate Formula: C11H12N3S2- MolecularWeight: 250.36308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN=C(N2C)[S-]

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN=C(N2C)[S-]

InChI

InChI=1S/C11H13N3S2/c1-8-3-5-9(6-4-8)16-7-10-12-13-11(15)14(10)2/h3-6H,7H2,1-2H3,(H,13,15)/p-1