Vitas-M small molecule compound
2-[(E)-{[3-(ethoxycarbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]iminio}methyl]-6-methoxyphenolate
Catalog ID
STK582019
SMILES CCOC(=O)c1c(/[NH+]=C/c2cccc(c2[O-])OC)sc2c1CCC2
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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 C18H19NO4S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4S/c1-3-23-18(21)15-12-7-5-9-14(12)24-17(15)19-10-11-6-4-8-13(22-2)16(11)20/h4,6,8,10,20H,3,5,7,9H2,1-2H3/b19-10+InChIKey
JELSNNUYZGGWKS-VXLYETTFSA-NSynonyms
348157-65-32((E)((3(ethoxycarbonyl)56dihydro4Hcyclopenta(b)thiophen2yl)iminio)methyl)6methoxyphenolate
348157653
CCOC(=O)c1c((NH+)=Cc2cccc(c2(O))OC)sc2c1CCC2
MFCD01119579
ZINC000002229938
ZINC000254842433
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