Vitas-M small molecule compound

(4E)-4-[(4-bromophenyl)(hydroxy)methylidene]-1-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione

Catalog ID
STK563636
SMILES Brc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1noc(c1)C(C)(C)C)/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 C24H20BrN3O6 MW 526.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrN3O6/c1-24(2,3)17-12-18(26-34-17)27-20(14-5-4-6-16(11-14)28(32)33)19(22(30)23(27)31)21(29)13-7-9-15(25)10-8-13/h4-12,20,29H,1-3H3/b21-19+
InChIKey
KEBDVNFCQQRJRR-XUTLUUPISA-N
Synonyms
440096-86-6
(4E)4((4bromophenyl)(hydroxy)methylidene)1(5tertbutyl12oxazol3yl)5(3nitrophenyl)pyrrolidine23dione
(4E)4((4BROMOPHENYL)HYDROXYMETHYLIDENE)1(5TERTBUTYL12OXAZOL3YL)5(3NITROPHENYL)PYRROLIDINE23DIONE
440096866
Brc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))c1noc(c1)C(C)(C)C)O
CC(C)(C)C1=CC(=NO1)N2C(C(=C(C3=CC=C(C=C3)Br)O)C(=O)C2=O)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC24H20BrN3O6c124(23)171218(263417)2720(1454616(1114)28(32)33)19(22(30)23(27)31)21(29)137915(25)10813h4122029H13H3b2119+
MFCD03818068
ZINC000101062494
ZINC000101062495

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Available files

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