Vitas-M small molecule compound
3-(4-ethylphenyl)-5-(4-fluorophenyl)-2-(3-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Catalog ID
STL055385
SMILES CCc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1cccc(c1)[N+](=O)[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 C25H20FN3O5 MW 461.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O5/c1-2-15-6-8-16(9-7-15)22-21-23(34-28(22)19-4-3-5-20(14-19)29(32)33)25(31)27(24(21)30)18-12-10-17(26)11-13-18/h3-14,21-23H,2H2,1H3InChIKey
INKGUAIAJDNUEY-UHFFFAOYSA-NSynonyms
1022046-14-51022046145
3(4ETHYLPHENYL)5(4FLUOROPHENYL)2(3NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(4ethylphenyl)5(4fluorophenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(4ethylphenyl)5(4fluorophenyl)2(3nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCC1=CC=C(C=C1)C2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)F)ON2C5=CC(=CC=C5)(N+)(=O)(O)
CCc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)c1cccc(c1)(N+)(=O)(O)
InChI=1SC25H20FN3O5c12156816(9715)222123(3428(22)1943520(1419)29(32)33)25(31)27(24(21)30)18121017(26)111318h3142123H2H21H3
MFCD04175906
ZINC000018099679
ZINC000143597997
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