Vitas-M small molecule compound
2-amino-4-(1,3-benzodioxol-5-yl)-8,10-dimethyl-7-oxo-4H,7H-furo[3',4':6,7]cyclohepta[1,2-b]pyran-3-carbonitrile
Catalog ID
STK699117
SMILES N#CC1=C(N)Oc2c(C1c1ccc3c(c1)OCO3)ccc(=O)c1c2c(C)oc1C
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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 C22H16N2O5 MW 388.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O5/c1-10-18-15(25)5-4-13-20(12-3-6-16-17(7-12)27-9-26-16)14(8-23)22(24)29-21(13)19(18)11(2)28-10/h3-7,20H,9,24H2,1-2H3InChIKey
VRKPQMLVOCGJRP-UHFFFAOYSA-NSynonyms
877778-65-92amino4(13benzodioxol5yl)810dimethyl7oxo4H7Hfuro(3467)cyclohepta(12b)pyran3carbonitrile
2amino4(13benzodioxol5yl)810dimethyl7oxo4Hfuro(12)cyclohepta(46d)pyran3carbonitrile
2amino4(benzo(d)(13)dioxol5yl)810dimethyl7oxo47dihydrofuro(3467)cyclohepta(12b)pyran3carbonitrile
877778659
CC1=C2C(=O)C=CC3=C(C2=C(O1)C)OC(=C(C3C4=CC5=C(C=C4)OCO5)C#N)N
InChI=1SC22H16N2O5c1101815(25)541320(12361617(712)2792616)14(823)22(24)2921(13)19(18)11(2)2810h3720H924H212H3
MFCD04320958
ZINC000005561071
ZINC000005561073
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