Vitas-M small molecule compound
(5E)-5-[4-(butan-2-yloxy)-3-ethoxybenzylidene]-3-(3-chloro-4-fluorophenyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK320470
SMILES CCOc1cc(ccc1OC(CC)C)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)Cl)F
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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 C22H21ClFNO3S2 MW 466.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFNO3S2/c1-4-13(3)28-18-9-6-14(10-19(18)27-5-2)11-20-21(26)25(22(29)30-20)15-7-8-17(24)16(23)12-15/h6-13H,4-5H2,1-3H3/b20-11+InChIKey
DNDBHGMCIGQHDT-RGVLZGJSSA-NSynonyms
(5E)5((4butan2yloxy3ethoxyphenyl)methylidene)3(3chloro4fluorophenyl)2sulfanylidene13thiazolidin4one
(5E)5(4(BUTAN2YLOXY)3ETHOXYBENZYLIDENE)3(3CHLORO4FLUOROPHENYL)2THIOXO13THIAZOLIDIN4ONE
CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC(=C(C=C3)F)Cl)OCC
CCOc1cc(ccc1OC(CC)C)C=C1SC(=S)N(C1=O)c1ccc(c(c1)Cl)F
InChI=1SC22H21ClFNO3S2c1413(3)28189614(1019(18)2752)112021(26)25(22(29)3020)157817(24)16(23)1215h613H45H213H3b2011+
MFCD04085660
ZINC000003769538
ZINC000003769540
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