Vitas-M small molecule compound
3-(4-bromophenyl)-5-(2-methoxy-5-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Catalog ID
STL234508
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C(=NN2c1ccccc1)c1ccc(cc1)Br)[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 C24H17BrN4O5 MW 521.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN4O5/c1-34-19-12-11-17(29(32)33)13-18(19)27-23(30)20-21(14-7-9-15(25)10-8-14)26-28(22(20)24(27)31)16-5-3-2-4-6-16/h2-13,20,22H,1H3InChIKey
RSNFWRSXIRZHGG-UHFFFAOYSA-NSynonyms
(3aS6aS)3(4bromophenyl)5(2methoxy5nitrophenyl)1phenyl16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
3(4bromophenyl)5(2methoxy5nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
3(4BROMOPHENYL)5(2METHOXY5NITROPHENYL)1PHENYL3A6ADIHYDROPYRROLO(34C)PYRAZOLE46DIONE
COC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)N(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5
COc1ccc(cc1N1C(=O)(C@@H)2(C@H)(C1=O)C(=NN2c1ccccc1)c1ccc(cc1)Br)(N+)(=O)(O)
COc1ccc(cc1N1C(=O)C2C(C1=O)C(=NN2c1ccccc1)c1ccc(cc1)Br)(N+)(=O)(O)
InChI=1SC24H17BrN4O5c13419121117(29(32)33)1318(19)2723(30)2021(147915(25)10814)2628(22(20)24(27)31)165324616h2132022H1H3
MFCD07211416
ZINC000100841657
ZINC000103519840
Check stock
See real-time availability and sample size for STL234508 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.