Vitas-M small molecule compound

3-(2-chloro-6-fluorophenyl)-5-(3-methoxyphenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STL055687
SMILES COc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)[N+](=O)[O-])c1c(F)cccc1Cl

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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 C24H17ClFN3O6 MW 497.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClFN3O6/c1-34-16-8-3-5-13(12-16)27-23(30)20-21(19-17(25)9-4-10-18(19)26)28(35-22(20)24(27)31)14-6-2-7-15(11-14)29(32)33/h2-12,20-22H,1H3
InChIKey
XFTLROUOYLTKNN-UHFFFAOYSA-N
Synonyms
1022709-90-5
1022709905
3(2CHLORO6FLUOROPHENYL)5(3METHOXYPHENYL)2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(2chloro6fluorophenyl)5(3methoxyphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(2chloro6fluorophenyl)5(3methoxyphenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
COC1=CC=CC(=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)(N+)(=O)(O))C5=C(C=CC=C5Cl)F
COc1cccc(c1)N1C(=O)C2C(C1=O)C(N(O2)c1cccc(c1)(N+)(=O)(O))c1c(F)cccc1Cl
InChI=1SC24H17ClFN3O6c1341683513(1216)2723(30)2021(1917(25)941018(19)26)28(3522(20)24(27)31)1462715(1114)29(32)33h2122022H1H3
MFCD05703700
ZINC000102767758
ZINC000245247785

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Available files

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