Vitas-M small molecule compound

methyl 3-amino-6-(1,3-benzodioxol-5-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxylate

Catalog ID
STL343725
SMILES COC(=O)c1sc2c(c1N)c(cc(n2)c1ccc2c(c1)OCO2)C(F)(F)F

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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 C17H11F3N2O4S MW 396.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11F3N2O4S/c1-24-16(23)14-13(21)12-8(17(18,19)20)5-9(22-15(12)27-14)7-2-3-10-11(4-7)26-6-25-10/h2-5H,6,21H2,1H3
InChIKey
FEPAFNQGKIYLPJ-UHFFFAOYSA-N
Synonyms
625377-31-3
625377313
COC(=O)C1=C(C2=C(S1)N=C(C=C2C(F)(F)F)C3=CC4=C(C=C3)OCO4)N
InChI=1SC17H11F3N2O4Sc12416(23)1413(21)128(17(1819)20)59(2215(12)2714)7231011(47)2662510h25H621H21H3
methyl3amino6(13benzodioxol5yl)4(trifluoromethyl)thieno(23b)pyridine2carboxylate
methyl3amino6(benzo(d)(13)dioxol5yl)4(trifluoromethyl)thieno(23b)pyridine2carboxylate
MFCD03697846
ZINC000001125848
ZINC01125848
ZINC1125848

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.