Vitas-M small molecule compound
(5E)-3-(4-chlorobenzyl)-5-[2-methoxy-4-(pyrrolidin-1-yl)benzylidene]-1,3-thiazolidine-2,4-dione
Catalog ID
STK155618
SMILES COc1cc(ccc1/C=C\1/SC(=O)N(C1=O)Cc1ccc(cc1)Cl)N1CCCC1
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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 C22H21ClN2O3S MW 428.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O3S/c1-28-19-13-18(24-10-2-3-11-24)9-6-16(19)12-20-21(26)25(22(27)29-20)14-15-4-7-17(23)8-5-15/h4-9,12-13H,2-3,10-11,14H2,1H3/b20-12+InChIKey
ODBXEIKQHOKBIU-UDWIEESQSA-NSynonyms
(5E)3((4CHLOROPHENYL)METHYL)5((2METHOXY4PYRROLIDIN1YLPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3(4CHLOROBENZYL)5(2METHOXY4(PYRROLIDIN1YL)BENZYLIDENE)13THIAZOLIDINE24DIONE
COC1=C(C=CC(=C1)N2CCCC2)C=C3C(=O)N(C(=O)S3)CC4=CC=C(C=C4)Cl
COc1cc(ccc1C=C1SC(=O)N(C1=O)Cc1ccc(cc1)Cl)N1CCCC1
InChI=1SC22H21ClN2O3Sc128191318(2410231124)9616(19)122021(26)25(22(27)2920)14154717(23)8515h491213H23101114H21H3b2012+
MFCD04356279
ZINC000001105228
ZINC01105228
ZINC1105228
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