Vitas-M small molecule compound
propan-2-yl [(3-cyano-6-methyl-4-oxo-1,4-dihydropyridin-2-yl)sulfanyl]acetate
Catalog ID
STK827046
SMILES N#Cc1c(SCC(=O)OC(C)C)[nH]c(cc1=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H14N2O3S MW 266.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O3S/c1-7(2)17-11(16)6-18-12-9(5-13)10(15)4-8(3)14-12/h4,7H,6H2,1-3H3,(H,14,15)InChIKey
LXTCDLWNGFIPTH-UHFFFAOYSA-NSynonyms
CC1=CC(=O)C(=C(N1)SCC(=O)OC(C)C)C#N
InChI=1SC12H14N2O3Sc17(2)1711(16)618129(513)10(15)48(3)1412h47H6H213H3(H1415)
MFCD10087151
N#Cc1c(SCC(=O)OC(C)C)(nH)c(cc1=O)C
propan2yl((3cyano6methyl4oxo14dihydropyridin2yl)sulfanyl)acetate
propan2yl2((3cyano6methyl4oxo1Hpyridin2yl)sulfanyl)acetate
ZINC000102499789
ZINC102499789
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