Vitas-M small molecule compound

4-acetylphenyl 3-chloro-1-benzothiophene-2-carboxylate

Catalog ID
STK126543
SMILES CC(=O)c1ccc(cc1)OC(=O)c1sc2c(c1Cl)cccc2

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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 C17H11ClO3S MW 330.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11ClO3S/c1-10(19)11-6-8-12(9-7-11)21-17(20)16-15(18)13-4-2-3-5-14(13)22-16/h2-9H,1H3
InChIKey
KBYMHSJOPUGQTH-UHFFFAOYSA-N
Synonyms

(4ACETYLPHENYL)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4ACETYLPHENYL3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4ACETYLPHENYL3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
CC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl
InChI=1SC17H11ClO3Sc110(19)116812(9711)2117(20)1615(18)13423514(13)2216h29H1H3
MFCD03773043
ZINC000000359023
ZINC00359023
ZINC359023

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Available files

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