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

Systemtic Name: 5-ethylsulfanyl-4-[(4-methylphenyl)methyl]-1,2,4-triazol-3-amine Openeye Name: 5-ethylsulfanyl-4-(p-tolylmethyl)-1,2,4-triazol-3-amine CAS Name: 5-(ethylthio)-4-[(4-methylphenyl)methyl]-1,2,4-triazol-3-amine IUPAC Name: 5-ethylsulfanyl-4-[(4-methylphenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [5-(ethylthio)-4-(4-methylbenzyl)-1,2,4-triazol-3-yl]amine Formula: C12H16N4S MolecularWeight: 248.34724

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1CC2=CC=C(C=C2)C)N

Isomeric SMILES

CCSC1=NN=C(N1CC2=CC=C(C=C2)C)N

InChI

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