Vitas-M small molecule compound
5-[(3-{(5E)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoyl)amino]-2-hydroxybenzoic acid
Catalog ID
STK590306
SMILES O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)S/C(=C/C=C/c2ccco2)/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 C20H16N2O6S2 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O6S2/c23-15-7-6-12(11-14(15)19(26)27)21-17(24)8-9-22-18(25)16(30-20(22)29)5-1-3-13-4-2-10-28-13/h1-7,10-11,23H,8-9H2,(H,21,24)(H,26,27)/b3-1+,16-5+InChIKey
VSAWFCQWAJWBBI-TZWKYVIBSA-NSynonyms
902322-62-75((3((5E)5((2E)3(furan2yl)prop2en1ylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)2hydroxybenzoicacid
5(3((5E)5((E)3(FURAN2YL)PROP2ENYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)2HYDROXYBENZOICACID
5(3((E)5((E)3(furan2yl)allylidene)4oxo2thioxothiazolidin3yl)propanamido)2hydroxybenzoicacid
902322627
C1=COC(=C1)C=CC=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC(=C(C=C3)O)C(=O)O
InChI=1SC20H16N2O6S2c23157612(1114(15)19(26)27)2117(24)892218(25)16(3020(22)29)5131342102813h17101123H89H2(H2124)(H2627)b31+165+
MFCD06791559
O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)SC(=CC=Cc2ccco2)C1=O
ZINC000009429032
ZINC9429032
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.