N-ethyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-ethyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-ethyl-3-(p-tolylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: N-ethyl-3-[(4-methylphenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: N-ethyl-3-[(4-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: ethyl-[3-[(4-methylbenzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NN1)SCC2=CC=C(C=C2)C

Isomeric SMILES

CCNC1=NC(=NN1)SCC2=CC=C(C=C2)C

InChI

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