Vitas-M small molecule compound

4-[5-(4-fluorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl 1-methyl-1H-pyrazole-5-carboxylate

Catalog ID
STL343633
SMILES COc1cc(ccc1OC(=O)c1ccnn1C)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)F)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 C29H23FN4O6 MW 542.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23FN4O6/c1-32-21(14-15-31-32)29(37)39-22-13-8-17(16-23(22)38-2)25-24-26(40-34(25)20-6-4-3-5-7-20)28(36)33(27(24)35)19-11-9-18(30)10-12-19/h3-16,24-26H,1-2H3
InChIKey
WWHDJJDKTKLCPB-UHFFFAOYSA-N
Synonyms
1212104-05-6
(4(5(4FLUOROPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)2METHYLPYRAZOLE3CARBOXYLATE
1212104056
4((3S3AR6AS)5(4FLUOROPHENYL)46DIOXO2PHENYLHEXAHYDRO2HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL1METHYL1HPYRAZOLE5CARBOXYLATE
4(5(4fluorophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenyl1methyl1Hpyrazole5carboxylate
4(5(4fluorophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)2methoxyphenyl1methyl1Hpyrazole5carboxylate
CN1C(=CC=N1)C(=O)OC2=C(C=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)F)ON3C6=CC=CC=C6)OC
InChI=1SC29H23FN4O6c13221(14153132)29(37)392213817(1623(22)382)252426(4034(25)206435720)28(36)33(27(24)35)1911918(30)101219h3162426H12H3
MFCD04168150
ZINC000002415814
ZINC000226902479

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Available files

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