Vitas-M small molecule compound
2-amino-4-[6-(2-chloropropyl)-4,7-dimethoxy-1,3-benzodioxol-5-yl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK692991
SMILES N#CC1=C(N)OC2=C(C1c1c(CC(Cl)C)c(OC)c3c(c1OC)OCO3)C(=O)CC(C2)(C)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 C24H27ClN2O6 MW 474.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O6/c1-11(25)6-12-17(20(30-5)22-21(19(12)29-4)31-10-32-22)16-13(9-26)23(27)33-15-8-24(2,3)7-14(28)18(15)16/h11,16H,6-8,10,27H2,1-5H3InChIKey
JASONTUHQHRIIS-UHFFFAOYSA-NSynonyms
2amino4(6(2chloropropyl)47dimethoxy13benzodioxol5yl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(6(2chloropropyl)47dimethoxy13benzodioxol5yl)77dimethyl5oxo68dihydro4Hchromene3carbonitrile
CC(CC1=C(C(=C2C(=C1OC)OCO2)OC)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)Cl
InChI=1SC24H27ClN2O6c111(25)61217(20(305)2221(19(12)294)31103222)1613(926)23(27)3315824(23)714(28)18(15)16h1116H681027H215H3
MFCD10039025
ZINC000015085444
ZINC000015085449
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