Vitas-M small molecule compound

(3aS,6aS)-3-(4-bromophenyl)-5-(2-methyl-4-nitrophenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione

Catalog ID
STK542421
SMILES Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1C)[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 C24H17BrN4O4 MW 505.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17BrN4O4/c1-14-13-18(29(32)33)11-12-19(14)27-23(30)20-21(15-7-9-16(25)10-8-15)26-28(22(20)24(27)31)17-5-3-2-4-6-17/h2-13,20,22H,1H3/t20-,22+/m1/s1
InChIKey
GPEIUVFPXJHHIO-IRLDBZIGSA-N
Synonyms
956981-09-2
(3aS6aS)3(4bromophenyl)5(2methyl4nitrophenyl)1phenyl16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)3(4bromophenyl)5(2methyl4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)3(4bromophenyl)5(2methyl4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46dione
956981092
Brc1ccc(cc1)C1=NN((C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1C)(N+)(=O)(O))c1ccccc1
CC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)N(N=C3C4=CC=C(C=C4)Br)C5=CC=CC=C5
InChI=1SC24H17BrN4O4c1141318(29(32)33)111219(14)2723(30)2021(157916(25)10815)2628(22(20)24(27)31)175324617h2132022H1H3t2022+m1s1
MFCD18241995
ZINC000100851231
ZINC100851231

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Available files

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