Vitas-M small molecule compound
methyl 6-amino-4-(4-chloro-1,3-benzodioxol-5-yl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Catalog ID
STK033316
SMILES COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc2c(c1Cl)OCO2)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 C18H15ClN2O7 MW 406.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O7/c1-24-12(22)5-11-14(18(23)25-2)13(9(6-20)17(21)28-11)8-3-4-10-16(15(8)19)27-7-26-10/h3-4,13H,5,7,21H2,1-2H3InChIKey
PCTANOUGUNMRIG-UHFFFAOYSA-NSynonyms
354554-24-8354554248
COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc2c(c1Cl)OCO2)C#N)N
COC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=C(C3=C(C=C2)OCO3)Cl)C(=O)OC
InChI=1SC18H15ClN2O7c12412(22)51114(18(23)252)13(9(620)17(21)2811)8341016(15(8)19)2772610h3413H5721H212H3
METHYL(4S)6AMINO4(4CHLORO13BENZODIOXOL5YL)5CYANO2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
METHYL2(6AMINO4(4CHLORO(2HBENZO(34D)13DIOXOLAN5YL))5CYANO3(METHOXYCARBONYL)4HPYRAN2YL)ACETATE
METHYL6AMINO4(4CHLORO13BENZODIOXOL5YL)5CYANO2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
methyl6amino4(4chlorobenzo(d)(13)dioxol5yl)5cyano2(2methoxy2oxoethyl)4Hpyran3carboxylate
MFCD01835794
STK033316
ZINC000001026275
ZINC000001026277
Check stock
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Check stock on Vitas-MAvailable files
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