Vitas-M small molecule compound

3-amino-N-(4-bromo-2-fluorophenyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide

Catalog ID
STK998519
SMILES COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1F)Br

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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 C21H15BrFN3O2S MW 472.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrFN3O2S/c1-28-13-4-2-3-11(9-13)16-8-6-14-18(24)19(29-21(14)26-16)20(27)25-17-7-5-12(22)10-15(17)23/h2-10H,24H2,1H3,(H,25,27)
InChIKey
CHKXFNAAWFDEJA-UHFFFAOYSA-N
Synonyms
488093-18-1
3aminoN(4bromo2fluorophenyl)6(3methoxyphenyl)thieno(23b)pyridine2carboxamide
488093181
COC1=CC=CC(=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC4=C(C=C(C=C4)Br)F)N
InChI=1SC21H15BrFN3O2Sc1281342311(913)16861418(24)19(2921(14)2616)20(27)25177512(22)1015(17)23h210H24H21H3(H2527)
MFCD03288035
ZINC000000661263
ZINC00661263
ZINC661263

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Available files

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