Vitas-M small molecule compound
4-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3,6-dichloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821192
SMILES CCN1C(=S)S/C(=C\c2ccc(cc2)OC(=O)c2sc3c(c2Cl)ccc(c3)Cl)/C1=O
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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 C21H13Cl2NO3S3 MW 494.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2NO3S3/c1-2-24-19(25)16(30-21(24)28)9-11-3-6-13(7-4-11)27-20(26)18-17(23)14-8-5-12(22)10-15(14)29-18/h3-10H,2H2,1H3/b16-9-InChIKey
NBTNJWXYSCYTTI-SXGWCWSVSA-NSynonyms
(4((Z)(3ethyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)36dichloro1benzothiophene2carboxylate
4((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl36dichloro1benzothiophene2carboxylate
CCN1C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)SC1=S
CCN1C(=S)SC(=Cc2ccc(cc2)OC(=O)c2sc3c(c2Cl)ccc(c3)Cl)C1=O
InChI=1SC21H13Cl2NO3S3c122419(25)16(3021(24)28)9113613(7411)2720(26)1817(23)148512(22)1015(14)2918h310H2H21H3b169
MFCD03462623
ZINC000026963380
ZINC26963380
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