Vitas-M small molecule compound
ethyl 6-amino-5-cyano-4-[4-(methoxycarbonyl)phenyl]-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK763935
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)C(=O)OC)C#N)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 C18H18N2O5 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5/c1-4-24-18(22)14-10(2)25-16(20)13(9-19)15(14)11-5-7-12(8-6-11)17(21)23-3/h5-8,15H,4,20H2,1-3H3InChIKey
SELWYIKBEUMYMX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)C(=O)OC)C#N)N)C
ethyl6amino5cyano4(4(methoxycarbonyl)phenyl)2methyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO4(4METHOXYCARBONYLPHENYL)2METHYL4HPYRAN3CARBOXYLATE
InChI=1SC18H18N2O5c142418(22)1410(2)2516(20)13(919)15(14)115712(8611)17(21)233h5815H420H213H3
MFCD02647909
ZINC000000036847
ZINC000000036848
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