Vitas-M small molecule compound
2-({3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-5-hydroxybenzoic acid
Catalog ID
STK595078
SMILES O=C(Nc1ccc(cc1C(=O)O)O)CCN1C(=S)S/C(=C\c2ccc(cc2)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/c21-12-3-1-11(2-4-12)9-16-18(26)23(20(29)30-16)8-7-17(25)22-15-6-5-13(24)10-14(15)19(27)28/h1-6,9-10,24H,7-8H2,(H,22,25)(H,27,28)/b16-9-InChIKey
PLLYOXQTBMPRDI-SXGWCWSVSA-NSynonyms
892635-57-3(Z)2(3(5(4fluorobenzylidene)4oxo2thioxothiazolidin3yl)propanamido)5hydroxybenzoicacid
2((3((5Z)5(4fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)5hydroxybenzoicacid
2(3((5Z)5((4FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)5HYDROXYBENZOICACID
892635573
C1=CC(=CC=C1C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=C(C=C(C=C3)O)C(=O)O)F
InChI=1SC20H15FN2O5S2c21123111(2412)91618(26)23(20(29)3016)8717(25)22156513(24)1014(15)19(27)28h1691024H78H2(H2225)(H2728)b169
MFCD06791928
O=C(Nc1ccc(cc1C(=O)O)O)CCN1C(=S)SC(=Cc2ccc(cc2)F)C1=O
ZINC000009044224
ZINC9044224
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