Vitas-M small molecule compound
9-(4-bromo-2-methylphenyl)-4-butyl-6-chloro-9,10-dihydro-2H,8H-chromeno[8,7-e][1,3]oxazin-2-one
Catalog ID
STK717739
SMILES CCCCc1cc(=O)oc2c1cc(Cl)c1c2CN(CO1)c1ccc(cc1C)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 C22H21BrClNO3 MW 462.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrClNO3/c1-3-4-5-14-9-20(26)28-21-16(14)10-18(24)22-17(21)11-25(12-27-22)19-7-6-15(23)8-13(19)2/h6-10H,3-5,11-12H2,1-2H3InChIKey
JLUHISDRZCBSHS-UHFFFAOYSA-NSynonyms
877787-20-7877787207
9(4BROMO2METHYLPHENYL)4BUTYL6CHLORO810DIHYDROPYRANO(23F)(13)BENZOXAZIN2ONE
9(4bromo2methylphenyl)4butyl6chloro910dihydro2H8Hchromeno(87e)(13)oxazin2one
9(4bromo2methylphenyl)4butyl6chloro910dihydrochromeno(87e)(13)oxazin2(8H)one
CCCCC1=CC(=O)OC2=C3CN(COC3=C(C=C12)Cl)C4=C(C=C(C=C4)Br)C
InChI=1SC22H21BrClNO3c134514920(26)282116(14)1018(24)2217(21)1125(122722)197615(23)813(19)2h610H351112H212H3
MFCD05701496
ZINC000009293385
ZINC09293385
ZINC9293385
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