Vitas-M small molecule compound
3-[(2E)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3(2H)-yl]propane-1-sulfonate
Catalog ID
STK377878
SMILES CCN1C(=S)S/C(=c\2/sc3c(n2CCCS(=O)(=O)[O-])cccc3)/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 C15H15N2O4S4 MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N2O4S4/c1-2-16-13(18)12(24-15(16)22)14-17(8-5-9-25(19,20)21)10-6-3-4-7-11(10)23-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,20,21)/p-1/b14-12+InChIKey
ZHNBFYMZDUSWSL-WYMLVPIESA-MSynonyms
3((2E)2(3ethyl4oxo2sulfanylidene13thiazolidin5ylidene)13benzothiazol3yl)propane1sulfonate
3((2E)2(3ethyl4oxo2thioxo13thiazolidin5ylidene)13benzothiazol3(2H)yl)propane1sulfonate
CCN1C(=O)C(=C2N(C3=CC=CC=C3S2)CCCS(=O)(=O)(O))SC1=S
CCN1C(=S)SC(=c2sc3c(n2CCCS(=O)(=O)(O))cccc3)C1=O
InChI=1SC15H16N2O4S4c121613(18)12(2415(16)22)1417(85925(1920)21)10634711(10)2314h3467H2589H21H3(H192021)p1b1412+
ZINC000018024938
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