Vitas-M small molecule compound

3-chloro-4-fluoro-N-(4H-1,2,4-triazol-4-yl)-1-benzothiophene-2-carboxamide

Catalog ID
STK453972
SMILES O=C(c1sc2c(c1Cl)c(F)ccc2)Nn1cnnc1

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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 C11H6ClFN4OS MW 296.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H6ClFN4OS/c12-9-8-6(13)2-1-3-7(8)19-10(9)11(18)16-17-4-14-15-5-17/h1-5H,(H,16,18)
InChIKey
YAOFYJHFMSNOFA-UHFFFAOYSA-N
Synonyms

(3CHLORO4FLUOROBENZO(B)THIOPHEN2YL)N(124TRIAZOL4YL)CARBOXAMIDE
3CHLORO4FLUORON(124TRIAZOL4YL)1BENZOTHIOPHENE2CARBOXAMIDE
3chloro4fluoroN(4H124triazol4yl)1benzothiophene2carboxamide
C1=CC(=C2C(=C1)SC(=C2Cl)C(=O)NN3C=NN=C3)F
InChI=1SC11H6ClFN4OSc12986(13)2137(8)1910(9)11(18)161741415517h15H(H1618)
MFCD04226540
ZINC000001054040
ZINC01054040
ZINC1054040

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Available files

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