Vitas-M small molecule compound

[3-amino-6-(pyridin-4-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl](1,3-benzodioxol-5-yl)methanone

Catalog ID
STL052772
SMILES O=C(c1sc2c(c1N)c(cc(n2)c1ccncc1)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 C21H12F3N3O3S MW 443.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12F3N3O3S/c22-21(23,24)12-8-13(10-3-5-26-6-4-10)27-20-16(12)17(25)19(31-20)18(28)11-1-2-14-15(7-11)30-9-29-14/h1-8H,9,25H2
InChIKey
GPJPZFNBDOVCLX-UHFFFAOYSA-N
Synonyms
626225-23-8
(3AMINO6(4PYRIDINYL)4(TRIFLUOROMETHYL)THIENO(23B)PYRIDIN2YL)(13BENZODIOXOL5YL)METHANONE
(3amino6(pyridin4yl)4(trifluoromethyl)thieno(23b)pyridin2yl)(13benzodioxol5yl)methanone
(3amino6(pyridin4yl)4(trifluoromethyl)thieno(23b)pyridin2yl)(benzo(d)(13)dioxol5yl)methanone
(3AMINO6PYRIDIN4YL4(TRIFLUOROMETHYL)THIENO(23B)PYRIDIN2YL)(13BENZODIOXOL5YL)METHANONE
2HBENZO(D)13DIOXOLEN5YL3AMINO6(4PYRIDYL)4(TRIFLUOROMETHYL)THIOPHENO(23B)PYRIDIN2YLKETONE
626225238
C1OC2=C(O1)C=C(C=C2)C(=O)C3=C(C4=C(S3)N=C(C=C4C(F)(F)F)C5=CC=NC=C5)N
InChI=1SC21H12F3N3O3Sc2221(2324)12813(1035266410)272016(12)17(25)19(3120)18(28)11121415(711)3092914h18H925H2
MFCD04109163
ZINC000001278187
ZINC01278187
ZINC1278187

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Available files

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