Vitas-M small molecule compound
2-({3-[(5Z)-5-(3-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-5-hydroxybenzoic acid
Catalog ID
STK995556
SMILES O=C(Nc1ccc(cc1C(=O)O)O)CCN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O
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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 C20H15FN2O5S2 MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O5S2/c21-12-3-1-2-11(8-12)9-16-18(26)23(20(29)30-16)7-6-17(25)22-15-5-4-13(24)10-14(15)19(27)28/h1-5,8-10,24H,6-7H2,(H,22,25)(H,27,28)/b16-9-InChIKey
QIKDXBANSWAINX-SXGWCWSVSA-NSynonyms
902027-77-4(Z)2(3(5(3fluorobenzylidene)4oxo2thioxothiazolidin3yl)propanamido)5hydroxybenzoicacid
2((3((5Z)5(3fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)5hydroxybenzoicacid
2(3((5Z)5((3FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)5HYDROXYBENZOICACID
2(3(5((3FLUOROPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))PROPANOYLAMINO)5HYDROXYBENZOICACID
902027774
C1=CC(=CC(=C1)F)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=C(C=C(C=C3)O)C(=O)O
InChI=1SC20H15FN2O5S2c211231211(812)91618(26)23(20(29)3016)7617(25)22155413(24)1014(15)19(27)28h1581024H67H2(H2225)(H2728)b169
MFCD06784928
O=C(Nc1ccc(cc1C(=O)O)O)CCN1C(=S)SC(=Cc2cccc(c2)F)C1=O
ZINC000009216187
ZINC9216187
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.