Vitas-M small molecule compound
2-amino-4-[3-ethoxy-4-(propan-2-yloxy)phenyl]-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK332768
SMILES CCOc1cc(ccc1OC(C)C)C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N
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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-5-25-16-9-13(6-7-15(16)26-11(2)3)18-14(10-22)20(23)28-17-8-12(4)27-21(24)19(17)18/h6-9,11,18H,5,23H2,1-4H3InChIKey
LCPWRRVPNVPLEX-UHFFFAOYSA-NSynonyms
371207-09-92AMINO4(3(ETHYLOXY)4((1METHYLETHYL)OXY)PHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2amino4(3ethoxy4(propan2yloxy)phenyl)7methyl5oxo4H5Hpyrano(43b)pyran3carbonitrile
2amino4(3ethoxy4isopropoxyphenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(3ETHOXY4ISOPROPOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(3ETHOXY4PROPAN2YLOXYPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
371207099
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC(=C3)C)N)C#N)OC(C)C
InChI=1SC21H22N2O5c152516913(6715(16)2611(2)3)1814(1022)20(23)2817812(4)2721(24)19(17)18h691118H523H214H3
MFCD02950159
ZINC000000658803
ZINC000000658805
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