Vitas-M small molecule compound

5-(biphenyl-3-yl)-3-(2-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STK569211
SMILES O=C1N(c2cccc(c2)c2ccccc2)C(=O)C2C1ON(C2c1ccccc1[N+](=O)[O-])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 C29H21N3O5 MW 491.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N3O5/c33-28-25-26(23-16-7-8-17-24(23)32(35)36)31(21-13-5-2-6-14-21)37-27(25)29(34)30(28)22-15-9-12-20(18-22)19-10-3-1-4-11-19/h1-18,25-27H
InChIKey
JRARFLXUKCVKRZ-UHFFFAOYSA-N
Synonyms
1022573-86-9
1022573869
3(2NITROPHENYL)2PHENYL5(3PHENYLPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
5((11biphenyl)3yl)3(2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
5(biphenyl3yl)3(2nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
5BIPHENYL3YL3(2NITROPHENYL)2PHENYLDIHYDRO2HPYRROLO(34D)ISOXAZOLE46(3H5H)DIONE
C1=CC=C(C=C1)C2=CC(=CC=C2)N3C(=O)C4C(N(OC4C3=O)C5=CC=CC=C5)C6=CC=CC=C6(N+)(=O)(O)
InChI=1SC29H21N3O5c33282526(2316781724(23)32(35)36)31(21135261421)3727(25)29(34)30(28)221591220(1822)19103141119h1182527H
MFCD05696942
O=C1N(c2cccc(c2)c2ccccc2)C(=O)C2C1ON(C2c1ccccc1(N+)(=O)(O))c1ccccc1
ZINC000102765499
ZINC000229916293

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Available files

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