Vitas-M small molecule compound
2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(2-chloro-4-fluorophenyl)acetamide
Catalog ID
STL031239
SMILES Fc1ccc(c(c1)Cl)NC(=O)Cn1c2ccsc2c(=O)n(c1=O)Cc1ccc2c(c1)OCO2
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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 C22H15ClFN3O5S MW 487.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClFN3O5S/c23-14-8-13(24)2-3-15(14)25-19(28)10-26-16-5-6-33-20(16)21(29)27(22(26)30)9-12-1-4-17-18(7-12)32-11-31-17/h1-8H,9-11H2,(H,25,28)InChIKey
KMGVQYJZZUKFIA-UHFFFAOYSA-NSynonyms
2(3(13benzodioxol5ylmethyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)N(2chloro4fluorophenyl)acetamide
2(3(13benzodioxol5ylmethyl)24dioxothieno(32d)pyrimidin1yl)N(2chloro4fluorophenyl)acetamide
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N(C3=O)CC(=O)NC5=C(C=C(C=C5)F)Cl
InChI=1SC22H15ClFN3O5Sc2314813(24)2315(14)2519(28)102616563320(16)21(29)27(22(26)30)912141718(712)32113117h18H911H2(H2528)
MFCD18191303
ZINC000067673613
ZINC67673613
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