Vitas-M small molecule compound
4-chloro-3-[5-(6,7-dimethyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridin-4-yl)furan-2-yl]benzoic acid
Catalog ID
STL567749
SMILES O=C1Oc2cc(C)n(c(=O)c2C(C1)c1ccc(o1)c1cc(ccc1Cl)C(=O)O)C
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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 C21H16ClNO6 MW 413.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClNO6/c1-10-7-17-19(20(25)23(10)2)13(9-18(24)29-17)16-6-5-15(28-16)12-8-11(21(26)27)3-4-14(12)22/h3-8,13H,9H2,1-2H3,(H,26,27)InChIKey
SNSSSNZMNYAYPP-UHFFFAOYSA-NSynonyms
128963421
4chloro3(5(67dimethyl25dioxo3456tetrahydro2Hpyrano(32c)pyridin4yl)furan2yl)benzoicacid
4chloro3(5(67dimethyl25dioxo34dihydropyrano(32c)pyridin4yl)furan2yl)benzoicacid
InChI=1SC21H16ClNO6c11071719(20(25)23(10)2)13(918(24)2917)166515(2816)12811(21(26)27)3414(12)22h3813H9H212H3(H2627)
MFCD32652932
ZINC000524735329
ZINC000524735330
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