Vitas-M small molecule compound
2-bromo-4-chlorophenyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate
Catalog ID
STK119908
SMILES COc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1Br)Cl
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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 C16H9BrCl2O3S MW 432.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9BrCl2O3S/c1-21-9-3-4-10-13(7-9)23-15(14(10)19)16(20)22-12-5-2-8(18)6-11(12)17/h2-7H,1H3InChIKey
JXSUAEKYCGZMBR-UHFFFAOYSA-NSynonyms
(2BROMO4CHLOROPHENYL)3CHLORO6METHOXY1BENZOTHIOPHENE2CARBOXYLATE
2BROMO4CHLOROPHENYL3CHLORO6METHOXY1BENZOTHIOPHENE2CARBOXYLATE
COC1=CC2=C(C=C1)C(=C(S2)C(=O)OC3=C(C=C(C=C3)Cl)Br)Cl
InChI=1SC16H9BrCl2O3Sc1219341013(79)2315(14(10)19)16(20)2212528(18)611(12)17h27H1H3
MFCD03773286
ZINC000009805624
ZINC09805624
ZINC9805624
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