CAS 16536-95-1
:3-Methylbutanethioamide
Description:
3-Methylbutanethioamide, with the CAS number 16536-95-1, is an organic compound classified as a thioamide. It features a thioamide functional group, which consists of a sulfur atom bonded to a carbonyl carbon and a nitrogen atom. This compound has a branched alkyl chain, specifically a methyl group attached to the third carbon of a butane backbone, contributing to its unique structural characteristics. Thioamides are known for their potential reactivity, particularly in nucleophilic substitution and condensation reactions. The presence of the sulfur atom can influence the compound's physical properties, such as solubility and boiling point, compared to its corresponding amide. 3-Methylbutanethioamide may exhibit specific biological activities, making it of interest in various fields, including medicinal chemistry and agrochemicals. Its synthesis typically involves the reaction of a suitable thioamide precursor with a methylated butane derivative. As with many thioamides, it is essential to handle this compound with care due to potential toxicity and reactivity.
Formula:C5H11NS
InChI:InChI=1S/C5H11NS/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H2,6,7)
InChI key:InChIKey=NFWCTMFZCLAVSD-UHFFFAOYSA-N
SMILES:C(C(C)C)C(N)=S
Synonyms:- Butanethioamide, 3-methyl-
- Isovalerothioamide
- 3-Methylbutanethioamide
- Thioisovaleramide
- Butyramide, 3-methylthio-
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