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

Systemtic Name: 3-[(3-methylphenyl)methylsulfanyl]-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-4-amine Openeye Name: 3-(5-methyl-1H-pyrazol-3-yl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-methylphenyl)methylthio]-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-methylphenyl)methylsulfanyl]-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-4-amine Traditional Name: [3-[(3-methylbenzyl)thio]-5-(5-methyl-1H-pyrazol-3-yl)-1,2,4-triazol-4-yl]amine Formula: C14H16N6S MolecularWeight: 300.38204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C3=NNC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C3=NNC(=C3)C

InChI

InChI=1S/C14H16N6S/c1-9-4-3-5-11(6-9)8-21-14-19-18-13(20(14)15)12-7-10(2)16-17-12/h3-7H,8,15H2,1-2H3,(H,16,17)