Vitas-M small molecule compound
3-(3,5-di-tert-butyl-4-hydroxyphenyl)-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Catalog ID
STK570060
SMILES O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)C2C1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N(O2)c1ccccc1
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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 C31H33N3O6 MW 543.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O6/c1-30(2,3)22-16-18(17-23(26(22)35)31(4,5)6)25-24-27(40-33(25)20-10-8-7-9-11-20)29(37)32(28(24)36)19-12-14-21(15-13-19)34(38)39/h7-17,24-25,27,35H,1-6H3InChIKey
DIIJGUKJVOJOLH-UHFFFAOYSA-NSynonyms
1024176-96-21024176962
3(35DITERTBUTYL4HYDROXYPHENYL)5(4NITROPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(35ditertbutyl4hydroxyphenyl)5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(35ditertbutyl4hydroxyphenyl)5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))ON2C5=CC=CC=C5
InChI=1SC31H33N3O6c130(23)221618(1723(26(22)35)31(45)6)252427(4033(25)20108791120)29(37)32(28(24)36)19121421(151319)34(38)39h71724252735H16H3
MFCD04169898
O=C1N(c2ccc(cc2)(N+)(=O)(O))C(=O)C2C1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N(O2)c1ccccc1
ZINC000097954375
ZINC000102745898
Check stock
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Check stock on Vitas-MAvailable files
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