2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H14N4OS MolecularWeight: 262.33076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=NN=C2SCC(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=NN=C2SCC(=O)N)C

InChI

InChI=1S/C12H14N4OS/c1-8-3-4-10(9(2)5-8)16-7-14-15-12(16)18-6-11(13)17/h3-5,7H,6H2,1-2H3,(H2,13,17)