2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(2,6-dimethylphenyl)acetamide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4OS/c1-10-7-6-8-11(2)13(10)17-12(21)9-22-15-18-14(19-20-15)16(3,4)5/h6-8H,9H2,1-5H3,(H,17,21)(H,18,19,20)