Vitas-M small molecule compound
(2-chloro-4-{(Z)-[2,4-dioxo-3-(3-phenylpropyl)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL296772
SMILES OC(=O)COc1ccc(cc1Cl)/C=C/1\SC(=O)N(C1=O)CCCc1ccccc1
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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 C21H18ClNO5S MW 431.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO5S/c22-16-11-15(8-9-17(16)28-13-19(24)25)12-18-20(26)23(21(27)29-18)10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12H,4,7,10,13H2,(H,24,25)/b18-12-InChIKey
XAUAKZZNQRPONI-PDGQHHTCSA-NSynonyms
(2chloro4((Z)(24dioxo3(3phenylpropyl)13thiazolidin5ylidene)methyl)phenoxy)aceticacid
2(2CHLORO4((Z)(24DIOXO3(3PHENYLPROPYL)13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETICACID
C1=CC=C(C=C1)CCCN2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Cl)SC2=O
InChI=1SC21H18ClNO5Sc22161115(8917(16)281319(24)25)121820(26)23(21(27)2918)1047145213614h1356891112H471013H2(H2425)b1812
MFCD03715390
OC(=O)COc1ccc(cc1Cl)C=C1SC(=O)N(C1=O)CCCc1ccccc1
ZINC000002817261
ZINC2817261
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