Vitas-M small molecule compound
(5E)-5-{3-ethoxy-4-[(3-methylbenzyl)oxy]benzylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK074951
SMILES CCOc1cc(ccc1OCc1cccc(c1)C)/C=C\1/SC(=O)N(C1=O)CC#C
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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 C23H21NO4S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO4S/c1-4-11-24-22(25)21(29-23(24)26)14-17-9-10-19(20(13-17)27-5-2)28-15-18-8-6-7-16(3)12-18/h1,6-10,12-14H,5,11,15H2,2-3H3/b21-14+InChIKey
LLVFUJUAWZHXMZ-KGENOOAVSA-NSynonyms
(5E)5((3ETHOXY4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)3PROP2YNYL13THIAZOLIDINE24DIONE
(5E)5(3ETHOXY4((3METHYLBENZYL)OXY)BENZYLIDENE)3(PROP2YN1YL)13THIAZOLIDINE24DIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)CC#C)OCC3=CC=CC(=C3)C
CCOc1cc(ccc1OCc1cccc(c1)C)C=C1SC(=O)N(C1=O)CC#C
InChI=1SC23H21NO4Sc14112422(25)21(2923(24)26)141791019(20(1317)2752)28151886716(3)1218h16101214H51115H223H3b2114+
MFCD03728195
STK074951
ZINC000004600231
ZINC04600231
ZINC4600231
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