Vitas-M small molecule compound
methyl 4-(3-ethyl-4-methyl-2-oxo-2H,8H-chromeno[8,7-e][1,3]oxazin-9(10H)-yl)benzoate
Catalog ID
STK885217
SMILES COC(=O)c1ccc(cc1)N1COc2c(C1)c1oc(=O)c(c(c1cc2)C)CC
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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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-4-16-13(2)17-9-10-19-18(20(17)28-22(16)25)11-23(12-27-19)15-7-5-14(6-8-15)21(24)26-3/h5-10H,4,11-12H2,1-3H3InChIKey
VFUKPWVAVWUKJB-UHFFFAOYSA-NSynonyms
CCC1=C(C2=C(C3=C(C=C2)OCN(C3)C4=CC=C(C=C4)C(=O)OC)OC1=O)C
InChI=1SC22H21NO5c141613(2)179101918(20(17)2822(16)25)1123(122719)157514(6815)21(24)263h510H41112H213H3
methyl4(3ethyl4methyl2oxo2H8Hchromeno(87e)(13)oxazin9(10H)yl)benzoate
methyl4(3ethyl4methyl2oxo810dihydropyrano(23f)(13)benzoxazin9yl)benzoate
MFCD14915908
ZINC000006900583
ZINC06900583
ZINC6900583
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