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

Systemtic Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[(2,5-dimethylphenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(2,5-dimethylbenzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C11H14N4S MolecularWeight: 234.32066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NNC(=N2)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NNC(=N2)N

InChI

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