Vitas-M small molecule compound
2-amino-4-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK693036
SMILES N#CC1=C(N)OC2=C(C1c1cc(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 C19H18N2O6 MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O6/c1-23-13-6-9(16(24-2)18-17(13)25-8-26-18)14-10(7-20)19(21)27-12-5-3-4-11(22)15(12)14/h6,14H,3-5,8,21H2,1-2H3InChIKey
BCOHJWMUMDSVSI-UHFFFAOYSA-NSynonyms
2amino4(47dimethoxy13benzodioxol5yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(47dimethoxy13benzodioxol5yl)5oxo5678tetrahydro4Hchromene3carbonitrile
COC1=C2C(=C(C(=C1)C3C(=C(OC4=C3C(=O)CCC4)N)C#N)OC)OCO2
InChI=1SC19H18N2O6c1231369(16(242)1817(13)2582618)1410(720)19(21)271253411(22)15(12)14h614H35821H212H3
MFCD10039113
ZINC000015085614
ZINC000015085616
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