Vitas-M small molecule compound

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

Catalog ID
STL006441
SMILES COc1cc(ccc1OC(=O)c1ccnn1C)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)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 C29H24N4O6 MW 524.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O6/c1-31-21(15-16-30-31)29(36)38-22-14-13-18(17-23(22)37-2)25-24-26(39-33(25)20-11-7-4-8-12-20)28(35)32(27(24)34)19-9-5-3-6-10-19/h3-17,24-26H,1-2H3
InChIKey
OQJYFRXZUDHKGP-UHFFFAOYSA-N
Synonyms
1022858-25-8
(4(46DIOXO25DIPHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)2METHYLPYRAZOLE3CARBOXYLATE
1022858258
4(46dioxo25diphenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenyl1methyl1Hpyrazole5carboxylate
4(46DIOXO25DIPHENYLHEXAHYDRO2HPYRROLO(34D)ISOXAZOL3YL)2METHOXYPHENYL1METHYL1HPYRAZOLE5CARBOXYLATE
CN1C(=CC=N1)C(=O)OC2=C(C=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC=CC=C5)ON3C6=CC=CC=C6)OC
InChI=1SC29H24N4O6c13121(15163031)29(36)3822141318(1723(22)372)252426(3933(25)20117481220)28(35)32(27(24)34)1995361019h3172426H12H3
MFCD04173912
ZINC000097954434
ZINC000226825032

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Available files

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