N-[3-[(2,4-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]ethanamide

Systemtic Name: N-[3-[(2,4-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]ethanamide Openeye Name: N-[3-[(2,4-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]acetamide CAS Name: N-[3-[(2,4-dimethylphenyl)methylthio]-1H-1,2,4-triazol-5-yl]acetamide IUPAC Name: N-[3-[(2,4-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]acetamide Traditional Name: N-[3-[(2,4-dimethylbenzyl)thio]-1H-1,2,4-triazol-5-yl]acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2=NNC(=N2)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2=NNC(=N2)NC(=O)C)C

InChI

InChI=1S/C13H16N4OS/c1-8-4-5-11(9(2)6-8)7-19-13-15-12(16-17-13)14-10(3)18/h4-6H,7H2,1-3H3,(H2,14,15,16,17,18)