Vitas-M small molecule compound
2-({2-[(5E)-5-(3-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-5-hydroxybenzoic acid
Catalog ID
STK630784
SMILES Oc1ccc(c(c1)C(=O)O)NC(=O)C(N1C(=S)S/C(=C/c2cccc(c2)F)/C1=O)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 C20H15FN2O5S2 MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O5S2/c1-10(17(25)22-15-6-5-13(24)9-14(15)19(27)28)23-18(26)16(30-20(23)29)8-11-3-2-4-12(21)7-11/h2-10,24H,1H3,(H,22,25)(H,27,28)/b16-8+InChIKey
DMQVJQPVJQMVTQ-LZYBPNLTSA-NSynonyms
(E)2(2(5(3fluorobenzylidene)4oxo2thioxothiazolidin3yl)propanamido)5hydroxybenzoicacid
2((2((5E)5(3fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)5hydroxybenzoicacid
2(2((5E)5((3FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)5HYDROXYBENZOICACID
CC(C(=O)NC1=C(C=C(C=C1)O)C(=O)O)N2C(=O)C(=CC3=CC(=CC=C3)F)SC2=S
InChI=1SC20H15FN2O5S2c110(17(25)22156513(24)914(15)19(27)28)2318(26)16(3020(23)29)81132412(21)711h21024H1H3(H2225)(H2728)b168+
MFCD06785290
Oc1ccc(c(c1)C(=O)O)NC(=O)C(N1C(=S)SC(=Cc2cccc(c2)F)C1=O)C
ZINC000009252627
ZINC000013569293
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