Vitas-M small molecule compound
3-[(2Z)-5-methoxy-2-(2-thioxobutylidene)thieno[2,3-e][1,3]benzothiazol-1(2H)-yl]propane-1-sulfonate
Catalog ID
STK080172
SMILES CCC(=S)/C=c/1\sc2c(n1CCCS(=O)(=O)[O-])c1sccc1c(c2)OC
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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 C17H18NO4S4 MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO4S4/c1-3-11(23)9-15-18(6-4-8-26(19,20)21)16-14(25-15)10-13(22-2)12-5-7-24-17(12)16/h5,7,9-10H,3-4,6,8H2,1-2H3,(H,19,20,21)/p-1/b15-9-InChIKey
MCUSHSFDXZTKOD-DHDCSXOGSA-MSynonyms
3((2Z)5METHOXY2(2SULFANYLIDENEBUTYLIDENE)THIENO(23E)(13)BENZOTHIAZOL1YL)PROPANE1SULFONATE3((2Z)5METHOXY2(2THIOXOBUTYLIDENE)THIENO(23E)(13)BENZOTHIAZOL1(2H)YL)PROPANE1SULFONATE
3(5METHOXY2(2THIOXOBUTYLIDENE)HYDROTHIOPHENO(23E)BENZOTHIAZOLYL)PROPANESULFONICACID
CCC(=S)C=C1N(C2=C(S1)C=C(C3=C2SC=C3)OC)CCCS(=O)(=O)(O)
CCC(=S)C=c1sc2c(n1CCCS(=O)(=O)(O))c1sccc1c(c2)OC
CCC(=S)C=c1sc2c(n1CCCS(=O)(=O)(O))c1sccc1c(c2)OC(Na+)
sodium(Z)3(5methoxy2(2thioxobutylidene)thieno(3256)benzo(12d)thiazol1(2H)yl)propane1sulfonate
Registry IDs
MFCD00643226ZINC000013574268
Check stock
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Check stock on Vitas-MAvailable files
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