Vitas-M small molecule compound

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

Catalog ID
STK048975
SMILES Brc1ccc(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 C15H8BrClO2S MW 367.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8BrClO2S/c16-9-5-7-10(8-6-9)19-15(18)14-13(17)11-3-1-2-4-12(11)20-14/h1-8H
InChIKey
DKMXZQNHAVTQOH-UHFFFAOYSA-N
Synonyms

(4BROMOPHENYL)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4BROMOPHENYL3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4BROMOPHENYL3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
Brc1ccc(cc1)OC(=O)c1sc2c(c1Cl)cccc2
C1=CC=C2C(=C1)C(=C(S2)C(=O)OC3=CC=C(C=C3)Br)Cl
InChI=1SC15H8BrClO2Sc1695710(869)1915(18)1413(17)11312412(11)2014h18H
MFCD02857189
STK048975
ZINC000002134608
ZINC02134608
ZINC2134608

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Available files

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