Vitas-M small molecule compound
methyl [9-(3-bromophenyl)-4-methyl-2-oxo-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]acetate
Catalog ID
STK604424
SMILES COC(=O)Cc1c(=O)oc2c(c1C)ccc1c2CN(CO1)c1cccc(c1)Br
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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 C21H18BrNO5 MW 444.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrNO5/c1-12-15-6-7-18-17(20(15)28-21(25)16(12)9-19(24)26-2)10-23(11-27-18)14-5-3-4-13(22)8-14/h3-8H,9-11H2,1-2H3InChIKey
XJLNAWXIYOCEGC-UHFFFAOYSA-NSynonyms
903588-78-3903588783
CC1=C(C(=O)OC2=C1C=CC3=C2CN(CO3)C4=CC(=CC=C4)Br)CC(=O)OC
InChI=1SC21H18BrNO5c11215671817(20(15)2821(25)16(12)919(24)262)1023(112718)1453413(22)814h38H911H212H3
methyl(9(3bromophenyl)4methyl2oxo910dihydro2H8Hchromeno(87e)(13)oxazin3yl)acetate
methyl2(9(3bromophenyl)4methyl2oxo28910tetrahydrochromeno(87e)(13)oxazin3yl)acetate
methyl2(9(3bromophenyl)4methyl2oxo810dihydropyrano(23f)(13)benzoxazin3yl)acetate
MFCD08291852
ZINC000009411061
ZINC09411061
ZINC9411061
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