4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: N-mesityl-4-[(4-methyl-1,2,4-triazol-3-yl)thio]butyramide Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NN=CN2C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NN=CN2C)C

InChI

InChI=1S/C16H22N4OS/c1-11-8-12(2)15(13(3)9-11)18-14(21)6-5-7-22-16-19-17-10-20(16)4/h8-10H,5-7H2,1-4H3,(H,18,21)