Vitas-M small molecule compound
(5E)-3-benzyl-5-{4-[3-(2-chlorophenoxy)propoxy]-3-ethoxybenzylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK095906
SMILES CCOc1cc(ccc1OCCCOc1ccccc1Cl)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C28H26ClNO4S2 MW 540.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClNO4S2/c1-2-32-25-17-21(13-14-24(25)34-16-8-15-33-23-12-7-6-11-22(23)29)18-26-27(31)30(28(35)36-26)19-20-9-4-3-5-10-20/h3-7,9-14,17-18H,2,8,15-16,19H2,1H3/b26-18+InChIKey
BERAAPMONLYQPZ-NLRVBDNBSA-NSynonyms
(5E)3benzyl5((4(3(2chlorophenoxy)propoxy)3ethoxyphenyl)methylidene)2sulfanylidene13thiazolidin4one
(5E)3BENZYL5(4(3(2CHLOROPHENOXY)PROPOXY)3ETHOXYBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CC3=CC=CC=C3)OCCCOC4=CC=CC=C4Cl
CCOc1cc(ccc1OCCCOc1ccccc1Cl)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC28H26ClNO4S2c1232251721(131424(25)3416815332312761122(23)29)182627(31)30(28(35)3626)192094351020h379141718H28151619H21H3b2618+
MFCD08672795
STK095906
ZINC000097959409
ZINC97959409
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