Vitas-M small molecule compound
(5E)-5-{3-chloro-5-methoxy-4-[(3-methylbenzyl)oxy]benzylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK090044
SMILES CCN1C(=S)S/C(=C/c2cc(Cl)c(c(c2)OC)OCc2cccc(c2)C)/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 C21H20ClNO3S2 MW 433.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClNO3S2/c1-4-23-20(24)18(28-21(23)27)11-15-9-16(22)19(17(10-15)25-3)26-12-14-7-5-6-13(2)8-14/h5-11H,4,12H2,1-3H3/b18-11+InChIKey
ZFXCESJUYKDCTJ-WOJGMQOQSA-NSynonyms
(5E)5((3CHLORO5METHOXY4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)3ETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(3CHLORO5METHOXY4((3METHYLBENZYL)OXY)BENZYLIDENE)3ETHYL2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC3=CC=CC(=C3)C)OC)SC1=S
CCN1C(=S)SC(=Cc2cc(Cl)c(c(c2)OC)OCc2cccc(c2)C)C1=O
InChI=1SC21H20ClNO3S2c142320(24)18(2821(23)27)1115916(22)19(17(1015)253)26121475613(2)814h511H412H213H3b1811+
MFCD02923407
STK090044
ZINC000006470417
ZINC06470417
ZINC6470417
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