Vitas-M small molecule compound

methyl 3-chloro-6-isothiocyanato-1-benzothiophene-2-carboxylate

Catalog ID
STK443208
SMILES S=C=Nc1ccc2c(c1)sc(c2Cl)C(=O)OC

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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 C11H6ClNO2S2 MW 283.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H6ClNO2S2/c1-15-11(14)10-9(12)7-3-2-6(13-5-16)4-8(7)17-10/h2-4H,1H3
InChIKey
UFJNHNZQPYPODQ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(C2=C(S1)C=C(C=C2)N=C=S)Cl
InChI=1SC11H6ClNO2S2c11511(14)109(12)7326(13516)48(7)1710h24H1H3
methyl3chloro6isothiocyanato1benzothiophene2carboxylate
METHYL3CHLORO6ISOTHIOCYANATOBENZO(B)THIOPHENE2CARBOXYLATE
MFCD04054707
ZINC000006490475
ZINC06490475
ZINC6490475

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Available files

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