2-[(4-methylphenyl)methyl]-5-methylsulfanyl-1,2,4-triazol-3-amine

Systemtic Name: 2-[(4-methylphenyl)methyl]-5-methylsulfanyl-1,2,4-triazol-3-amine Openeye Name: 5-methylsulfanyl-2-(p-tolylmethyl)-1,2,4-triazol-3-amine CAS Name: 2-[(4-methylphenyl)methyl]-5-(methylthio)-1,2,4-triazol-3-amine IUPAC Name: 2-[(4-methylphenyl)methyl]-5-methylsulfanyl-1,2,4-triazol-3-amine Traditional Name: [2-(4-methylbenzyl)-5-(methylthio)-1,2,4-triazol-3-yl]amine Formula: C11H14N4S MolecularWeight: 234.32066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=NC(=N2)SC)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=NC(=N2)SC)N

InChI

InChI=1S/C11H14N4S/c1-8-3-5-9(6-4-8)7-15-10(12)13-11(14-15)16-2/h3-6H,7H2,1-2H3,(H2,12,13,14)