Vitas-M small molecule compound
5-[(3,4-dimethoxyphenyl)sulfonyl]-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STL081177
SMILES COc1cc(ccc1OC)S(=O)(=O)c1c[nH]c(=S)[nH]c1=O
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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 C12H12N2O5S2 MW 328.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O5S2/c1-18-8-4-3-7(5-9(8)19-2)21(16,17)10-6-13-12(20)14-11(10)15/h3-6H,1-2H3,(H2,13,14,15,20)InChIKey
XIYFMGBWRJLZLB-UHFFFAOYSA-NSynonyms
931314-47-55((34dimethoxyphenyl)sulfonyl)2thioxo23dihydropyrimidin4(1H)one
5(34dimethoxyphenyl)sulfonyl2sulfanylidene1Hpyrimidin4one
931314475
COC1=C(C=C(C=C1)S(=O)(=O)C2=CNC(=S)NC2=O)OC
COc1cc(ccc1OC)S(=O)(=O)c1c(nH)c(=S)(nH)c1=O
InChI=1SC12H12N2O5S2c1188437(59(8)192)21(1617)1061312(20)1411(10)15h36H12H3(H213141520)
MFCD14728149
ZINC000020849154
ZINC20849154
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