Vitas-M small molecule compound
methyl 6-amino-5-cyano-4-[3-ethoxy-4-(propan-2-yloxy)phenyl]-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Catalog ID
STK086034
SMILES CCOc1cc(ccc1OC(C)C)C1C(=C(N)OC(=C1C(=O)OC)CC(=O)OC)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 C22H26N2O7 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O7/c1-6-29-16-9-13(7-8-15(16)30-12(2)3)19-14(11-23)21(24)31-17(10-18(25)27-4)20(19)22(26)28-5/h7-9,12,19H,6,10,24H2,1-5H3InChIKey
OXDORFDATKFLCN-UHFFFAOYSA-NSynonyms
364746-78-1364746781
CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OC)CC(=O)OC)N)C#N)OC(C)C
CCOc1cc(ccc1OC(C)C)C1C(=C(N)OC(=C1C(=O)OC)CC(=O)OC)C#N
InChI=1SC22H26N2O7c162916913(7815(16)3012(2)3)1914(1123)21(24)3117(1018(25)274)20(19)22(26)285h791219H61024H215H3
METHYL6AMINO5CYANO4(3ETHOXY4(PROPAN2YLOXY)PHENYL)2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
methyl6amino5cyano4(3ethoxy4isopropoxyphenyl)2(2methoxy2oxoethyl)4Hpyran3carboxylate
METHYL6AMINO5CYANO4(3ETHOXY4PROPAN2YLOXYPHENYL)2(2METHOXY2OXOETHYL)4HPYRAN3CARBOXYLATE
MFCD01858794
STK086034
ZINC000002270137
ZINC000002270138
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