Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-3-[(5E)-5-(2-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Catalog ID
STL035892
SMILES O=C(Nc1ccc2c(c1)OCO2)CCN1C(=S)S/C(=C/c2ccccc2F)/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 C20H15FN2O4S2 MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15FN2O4S2/c21-14-4-2-1-3-12(14)9-17-19(25)23(20(28)29-17)8-7-18(24)22-13-5-6-15-16(10-13)27-11-26-15/h1-6,9-10H,7-8,11H2,(H,22,24)/b17-9+InChIKey
NHKCQLDGAMRPSJ-RQZCQDPDSA-NSynonyms
C1OC2=C(O1)C=C(C=C2)NC(=O)CCN3C(=O)C(=CC4=CC=CC=C4F)SC3=S
InChI=1SC20H15FN2O4S2c2114421312(14)91719(25)23(20(28)2917)8718(24)2213561516(1013)27112615h16910H7811H2(H2224)b179+
MFCD18192226
N(13benzodioxol5yl)3((5E)5((2fluorophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)propanamide
N(13benzodioxol5yl)3((5E)5(2fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)propanamide
O=C(Nc1ccc2c(c1)OCO2)CCN1C(=S)SC(=Cc2ccccc2F)C1=O
ZINC000027530572
ZINC27530572
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