Vitas-M small molecule compound

2-acetyl-1-benzothiophen-3-yl 3-bromobenzoate

Catalog ID
STK869285
SMILES Brc1cccc(c1)C(=O)Oc1c(sc2c1cccc2)C(=O)C

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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 C17H11BrO3S MW 375.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11BrO3S/c1-10(19)16-15(13-7-2-3-8-14(13)22-16)21-17(20)11-5-4-6-12(18)9-11/h2-9H,1H3
InChIKey
MYYSRVQFBHMYSD-UHFFFAOYSA-N
Synonyms
312584-63-7
(2ACETYL1BENZOTHIOPHEN3YL)3BROMOBENZOATE
2ACETYL1BENZOTHIEN3YL3BROMOBENZOATE
2acetyl1benzothiophen3yl3bromobenzoate
2ACETYLBENZO(B)THIOPHEN3YL3BROMOBENZOATE
312584637
CC(=O)C1=C(C2=CC=CC=C2S1)OC(=O)C3=CC(=CC=C3)Br
InChI=1SC17H11BrO3Sc110(19)1615(13723814(13)2216)2117(20)1154612(18)911h29H1H3
MFCD01958015
ZINC000000704123
ZINC00704123
ZINC704123

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Available files

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