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

Systemtic Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Openeye Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine CAS Name: 3-[(3,5-dimethylphenyl)methylthio]-5-methyl-1,2,4-triazol-4-amine IUPAC Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-5-methyl-1,2,4-triazol-4-amine Traditional Name: [3-[(3,5-dimethylbenzyl)thio]-5-methyl-1,2,4-triazol-4-yl]amine Formula: C12H16N4S MolecularWeight: 248.34724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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