Vitas-M small molecule compound
3-(4-methoxyphenyl)-9-(propan-2-yl)-2-(trifluoromethyl)-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-4-one
Catalog ID
STL099256
SMILES COc1ccc(cc1)c1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)C(C)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 C22H20F3NO4 MW 419.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20F3NO4/c1-12(2)26-10-16-17(29-11-26)9-8-15-19(27)18(13-4-6-14(28-3)7-5-13)21(22(23,24)25)30-20(15)16/h4-9,12H,10-11H2,1-3H3InChIKey
MNNHJPJOLYFQPR-UHFFFAOYSA-NSynonyms
951994-13-13(4METHOXYPHENYL)9(METHYLETHYL)2(TRIFLUOROMETHYL)8H10HCHROMENO(87E)13OXAZAPERHYDROIN4ONE
3(4methoxyphenyl)9(propan2yl)2(trifluoromethyl)910dihydro4H8Hchromeno(87e)(13)oxazin4one
3(4methoxyphenyl)9propan2yl2(trifluoromethyl)810dihydropyrano(23f)(13)benzoxazin4one
951994131
9ISOPROPYL3(4METHOXYPHENYL)2(TRIFLUOROMETHYL)910DIHYDROCHROMENO(87E)(13)OXAZIN4(8H)ONE
CC(C)N1CC2=C(C=CC3=C2OC(=C(C3=O)C4=CC=C(C=C4)OC)C(F)(F)F)OC1
InChI=1SC22H20F3NO4c112(2)26101617(291126)981519(27)18(134614(283)7513)21(22(2324)25)3020(15)16h4912H1011H213H3
MFCD09858377
ZINC000013733891
ZINC13733891
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