Vitas-M small molecule compound
2-{[6-(azepan-1-ylmethyl)-4-oxo-4H-pyran-3-yl]oxy}-N-(2,4-dichlorophenyl)acetamide
Catalog ID
STL248009
SMILES O=C(Nc1ccc(cc1Cl)Cl)COc1coc(cc1=O)CN1CCCCCC1
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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 C20H22Cl2N2O4 MW 425.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22Cl2N2O4/c21-14-5-6-17(16(22)9-14)23-20(26)13-28-19-12-27-15(10-18(19)25)11-24-7-3-1-2-4-8-24/h5-6,9-10,12H,1-4,7-8,11,13H2,(H,23,26)InChIKey
KKHAYBNZQBHAFN-UHFFFAOYSA-NSynonyms
1374542-22-91374542229
2((6(azepan1ylmethyl)4oxo4Hpyran3yl)oxy)N(24dichlorophenyl)acetamide
2(6(azepan1ylmethyl)4oxopyran3yl)oxyN(24dichlorophenyl)acetamide
C1CCCN(CC1)CC2=CC(=O)C(=CO2)OCC(=O)NC3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H22Cl2N2O4c21145617(16(22)914)2320(26)132819122715(1018(19)25)112473124824h5691012H14781113H2(H2326)
MFCD22203659
ZINC000072405226
ZINC72405226
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