Vitas-M small molecule compound
{[3-(1,3-benzothiazol-3-ium-2-yl)-6-ethyl-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetate
Catalog ID
STL514106
SMILES CCc1cc2c(cc1OCC(=O)[O-])oc(c(c2=O)c1sc2c([nH+]1)cccc2)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 C21H17NO5S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO5S/c1-3-12-8-13-16(9-15(12)26-10-18(23)24)27-11(2)19(20(13)25)21-22-14-6-4-5-7-17(14)28-21/h4-9H,3,10H2,1-2H3,(H,23,24)InChIKey
OBTLGMHEQZMZPW-UHFFFAOYSA-NSynonyms
610758-82-2((3(13benzothiazol3ium2yl)6ethyl2methyl4oxo4Hchromen7yl)oxy)acetate
1415788
610758822
MFCD03266931
ZINC000001296566
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