Vitas-M small molecule compound
3-(3-bromo-4-hydroxy-5-methoxyphenyl)-5-(4-ethylphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Catalog ID
STL057638
SMILES CCc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1cc(Br)c(c(c1)OC)O
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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 C26H22BrN3O7 MW 568.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrN3O7/c1-3-14-7-9-16(10-8-14)28-25(32)21-22(15-11-19(27)23(31)20(12-15)36-2)29(37-24(21)26(28)33)17-5-4-6-18(13-17)30(34)35/h4-13,21-22,24,31H,3H2,1-2H3InChIKey
KMSZUBVANVMKLU-UHFFFAOYSA-NSynonyms
1024373-79-21024373792
3(3BROMO4HYDROXY5METHOXYPHENYL)5(4ETHYLPHENYL)2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(3bromo4hydroxy5methoxyphenyl)5(4ethylphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(3bromo4hydroxy5methoxyphenyl)5(4ethylphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=CC(=C(C(=C5)Br)O)OC
CCc1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)(N+)(=O)(O))c1cc(Br)c(c(c1)OC)O
InChI=1SC26H22BrN3O7c13147916(10814)2825(32)2122(151119(27)23(31)20(1215)362)29(3724(21)26(28)33)1754618(1317)30(34)35h41321222431H3H212H3
MFCD05729557
ZINC000105990176
ZINC000245246397
Check stock
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Check stock on Vitas-MAvailable files
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