Vitas-M small molecule compound
2-amino-4-(1,3-benzodioxol-5-yl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK870500
SMILES N#CC1=C(N)Oc2c(C1c1ccc3c(c1)OCO3)c(=O)oc(c2)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 C17H12N2O5 MW 324.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N2O5/c1-8-4-13-15(17(20)23-8)14(10(6-18)16(19)24-13)9-2-3-11-12(5-9)22-7-21-11/h2-5,14H,7,19H2,1H3InChIKey
VYTYKAXFCRPOLC-UHFFFAOYSA-NSynonyms
315246-09-42amino4(13benzodioxol5yl)7methyl5oxo4H5Hpyrano(43b)pyran3carbonitrile
2AMINO4(13BENZODIOXOL5YL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
2amino4(benzo(d)(13)dioxol5yl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
4(2HBENZO(34D)13DIOXOLAN5YL)2AMINO7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC4=C(C=C3)OCO4)C(=O)O1
Registry IDs
MFCD00543713ZINC000000043000
ZINC000000043001
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