Vitas-M small molecule compound
(5Z)-5-{[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK813503
SMILES CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(c(c2)Cl)OC)c2ccccc2)/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 C22H18ClN3O2S2 MW 455.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O2S2/c1-3-25-21(27)19(30-22(25)29)12-15-13-26(16-7-5-4-6-8-16)24-20(15)14-9-10-18(28-2)17(23)11-14/h4-13H,3H2,1-2H3/b19-12-InChIKey
ODYQEFXSDRUCSV-UNOMPAQXSA-NSynonyms
(5Z)5((3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)3ethyl2thioxo13thiazolidin4one
(5Z)5((3(3chloro4methoxyphenyl)1phenylpyrazol4yl)methylidene)3ethyl2sulfanylidene13thiazolidin4one
5((3(3CHLORO4METHOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3ETHYL2THIOXOTHIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CN(N=C2C3=CC(=C(C=C3)OC)Cl)C4=CC=CC=C4)SC1=S
CCN1C(=S)SC(=Cc2cn(nc2c2ccc(c(c2)Cl)OC)c2ccccc2)C1=O
InChI=1SC22H18ClN3O2S2c132521(27)19(3022(25)29)12151326(167546816)2420(15)1491018(282)17(23)1114h413H3H212H3b1912
MFCD03514180
ZINC000016730225
ZINC16730225
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