Vitas-M small molecule compound
methyl 3,3,3-trifluoro-2-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)alaninate
Catalog ID
STK691164
SMILES COc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OC)OC
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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 C13H13F3N2O4S MW 350.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13F3N2O4S/c1-20-7-4-5-8-9(6-7)23-11(17-8)18-12(22-3,10(19)21-2)13(14,15)16/h4-6H,1-3H3,(H,17,18)InChIKey
ZABXHLJORLQINY-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1)N=C(S2)NC(C(=O)OC)(C(F)(F)F)OC
InChI=1SC13H13F3N2O4Sc12074589(67)2311(178)1812(22310(19)212)13(1415)16h46H13H3(H1718)
methyl333trifluoro2methoxy2((6methoxy13benzothiazol2yl)amino)propanoate
methyl333trifluoro2methoxyN(6methoxy13benzothiazol2yl)alaninate
MFCD09064174
ZINC000012371494
ZINC000012371495
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