Vitas-M small molecule compound

4-hydroxy-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-8-(trifluoromethyl)quinoline-3-carboxamide

Catalog ID
STK635111
SMILES Cc1n[nH]/c(=N/C(=O)c2cnc3c(c2O)cccc3C(F)(F)F)/s1

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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 C14H9F3N4O2S MW 354.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9F3N4O2S/c1-6-20-21-13(24-6)19-12(23)8-5-18-10-7(11(8)22)3-2-4-9(10)14(15,16)17/h2-5H,1H3,(H,18,22)(H,19,21,23)
InChIKey
KBBDITSERJXLED-UHFFFAOYSA-N
Synonyms
946260-46-4
(4HYDROXY8(TRIFLUOROMETHYL)(3QUINOLYL))N(5METHYL(134THIADIAZOL2YL))CARBOXAMIDE
4hydroxyN((2Z)5methyl134thiadiazol2(3H)ylidene)8(trifluoromethyl)quinoline3carboxamide
4HYDROXYN(5METHYL134THIADIAZOL2YL)8(TRIFLUOROMETHYL)QUINOLINE3CARBOXAMIDE
946260464
CC1=NN=C(S1)NC(=O)C2=CNC3=C(C2=O)C=CC=C3C(F)(F)F
Cc1n(nH)c(=NC(=O)c2cnc3c(c2O)cccc3C(F)(F)F)s1
InChI=1SC14H9F3N4O2Sc16202113(246)1912(23)8518107(11(8)22)3249(10)14(1516)17h25H1H3(H1822)(H192123)
MFCD18160617
N(5methyl134thiadiazol2yl)4oxo8(trifluoromethyl)1Hquinoline3carboxamide
ZINC000011027319
ZINC11027319

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Available files

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