Vitas-M small molecule compound
4-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 3-chloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821643
SMILES CCN1C(=S)S/C(=C\c2ccc(c(c2)OC)OC(=O)c2sc3c(c2Cl)cccc3)/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 C22H16ClNO4S3 MW 490.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClNO4S3/c1-3-24-20(25)17(31-22(24)29)11-12-8-9-14(15(10-12)27-2)28-21(26)19-18(23)13-6-4-5-7-16(13)30-19/h4-11H,3H2,1-2H3/b17-11-InChIKey
FCSLPZZHKTYNLN-BOPFTXTBSA-NSynonyms
(4((Z)(3ethyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenyl)3chloro1benzothiophene2carboxylate
4((Z)(3ethyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl3chloro1benzothiophene2carboxylate
CCN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=C(C4=CC=CC=C4S3)Cl)OC)SC1=S
CCN1C(=S)SC(=Cc2ccc(c(c2)OC)OC(=O)c2sc3c(c2Cl)cccc3)C1=O
InChI=1SC22H16ClNO4S3c132420(25)17(3122(24)29)11128914(15(1012)272)2821(26)1918(23)13645716(13)3019h411H3H212H3b1711
MFCD01458102
ZINC000026965333
ZINC26965333
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