Vitas-M small molecule compound
{2-ethoxy-4-[(E)-{3-[3-(methylsulfanyl)phenyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetic acid
Catalog ID
STK255799
SMILES CCOc1cc(ccc1OCC(=O)O)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)SC
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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 C21H19NO5S3 MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO5S3/c1-3-26-17-9-13(7-8-16(17)27-12-19(23)24)10-18-20(25)22(21(28)30-18)14-5-4-6-15(11-14)29-2/h4-11H,3,12H2,1-2H3,(H,23,24)/b18-10+InChIKey
CKGZVIQKGHWVLT-VCHYOVAHSA-NSynonyms
(2ethoxy4((E)(3(3(methylsulfanyl)phenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)phenoxy)aceticacid
2(2ethoxy4((E)(3(3methylsulfanylphenyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenoxy)aceticacid
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=CC=C3)SC)OCC(=O)O
CCOc1cc(ccc1OCC(=O)O)C=C1SC(=S)N(C1=O)c1cccc(c1)SC
InChI=1SC21H19NO5S3c132617913(7816(17)271219(23)24)101820(25)22(21(28)3018)1454615(1114)292h411H312H212H3(H2324)b1810+
MFCD08680879
ZINC000009295501
ZINC9295501
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