Vitas-M small molecule compound
[3-amino-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl](1,3-benzodioxol-5-yl)methanone
Catalog ID
STK694917
SMILES O=C(c1sc2c(c1N)c(c1c(n2)CCCC1)C(F)(F)F)c1ccc2c(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 C20H15F3N2O3S MW 420.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N2O3S/c21-20(22,23)15-10-3-1-2-4-11(10)25-19-14(15)16(24)18(29-19)17(26)9-5-6-12-13(7-9)28-8-27-12/h5-7H,1-4,8,24H2InChIKey
YDVFAWLEFXCESU-UHFFFAOYSA-NSynonyms
(3amino4(trifluoromethyl)5678tetrahydrothieno(23b)quinolin2yl)(13benzodioxol5yl)methanone
C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)C4=CC5=C(C=C4)OCO5)N)C(F)(F)F
InChI=1SC20H15F3N2O3Sc2120(2223)1510312411(10)251914(15)16(24)18(2919)17(26)9561213(79)2882712h57H14824H2
MFCD12035103
ZINC000035326264
ZINC35326264
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