Vitas-M small molecule compound
2-amino-4-[6-(2-chloropropyl)-4,7-dimethoxy-1,3-benzodioxol-5-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK693180
SMILES N#CC1=C(N)OC2=C(C1c1c(CC(Cl)C)c(OC)c3c(c1OC)OCO3)C(=O)CCC2
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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 C22H23ClN2O6 MW 446.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O6/c1-10(23)7-11-16(19(28-3)21-20(18(11)27-2)29-9-30-21)15-12(8-24)22(25)31-14-6-4-5-13(26)17(14)15/h10,15H,4-7,9,25H2,1-3H3InChIKey
QQRVEBGQQXXYNC-UHFFFAOYSA-NSynonyms
2amino4(6(2chloropropyl)47dimethoxy13benzodioxol5yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(6(2chloropropyl)47dimethoxy13benzodioxol5yl)5oxo5678tetrahydro4Hchromene3carbonitrile
CC(CC1=C(C(=C2C(=C1OC)OCO2)OC)C3C(=C(OC4=C3C(=O)CCC4)N)C#N)Cl
InChI=1SC22H23ClN2O6c110(23)71116(19(283)2120(18(11)272)2993021)1512(824)22(25)311464513(26)17(14)15h1015H47925H213H3
MFCD10039251
ZINC000015086076
ZINC000015086082
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