Vitas-M small molecule compound
ethyl 6-amino-5-cyano-4-[5-(ethylsulfanyl)-2-methylfuran-3-yl]-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK683066
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1cc(oc1C)SCC)C#N)N
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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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-5-21-17(20)14-10(4)23-16(19)12(8-18)15(14)11-7-13(24-6-2)22-9(11)3/h7,15H,5-6,19H2,1-4H3InChIKey
SHSJGSMFBFYJJT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=C(OC(=C2)SCC)C)C#N)N)C
ethyl6amino5cyano4(5(ethylsulfanyl)2methylfuran3yl)2methyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO4(5(ETHYLTHIO)2METHYL3FURYL)2METHYL4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO4(5ETHYLSULFANYL2METHYLFURAN3YL)2METHYL4HPYRAN3CARBOXYLATE
InChI=1SC17H20N2O4Sc152117(20)1410(4)2316(19)12(818)15(14)11713(2462)229(11)3h715H5619H214H3
MFCD03883608
ZINC000001421400
ZINC000001421401
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