Vitas-M small molecule compound
4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)-2-methoxyphenyl acetate
Catalog ID
STK375817
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)OC)OC(=O)C)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 C19H18N2O5 MW 354.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O5/c1-10(22)25-14-7-6-11(8-16(14)24-2)17-12(9-20)19(21)26-15-5-3-4-13(23)18(15)17/h6-8,17H,3-5,21H2,1-2H3InChIKey
XQPPLTBYFRXUTE-UHFFFAOYSA-NSynonyms
(4(2amino3cyano5oxo4678tetrahydrochromen4yl)2methoxyphenyl)acetate
4(2amino3cyano5oxo5678tetrahydro4Hchromen4yl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OC
InChI=1SC19H18N2O5c110(22)25147611(816(14)242)1712(920)19(21)261553413(23)18(15)17h6817H3521H212H3
MFCD01193776
ZINC000000706368
ZINC000000706369
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