Vitas-M small molecule compound

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

Catalog ID
STK543422
SMILES Brc1ccc(cc1)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)[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 C23H15BrN4O4 MW 491.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15BrN4O4/c24-15-8-6-14(7-9-15)20-19-21(27(25-20)17-4-2-1-3-5-17)23(30)26(22(19)29)16-10-12-18(13-11-16)28(31)32/h1-13,19,21H/t19-,21+/m1/s1
InChIKey
GCJGOOWWYFJDCR-CTNGQTDRSA-N
Synonyms
1014060-91-3
(3aS6aS)3(4bromophenyl)5(4nitrophenyl)1phenyl16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)3(4bromophenyl)5(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)3(4bromophenyl)5(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46dione
1014060913
Brc1ccc(cc1)C1=NN((C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
C1=CC=C(C=C1)N2C3C(C(=N2)C4=CC=C(C=C4)Br)C(=O)N(C3=O)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC23H15BrN4O4c24158614(7915)201921(27(2520)174213517)23(30)26(22(19)29)16101218(131116)28(31)32h1131921Ht1921+m1s1
MFCD18242084
ZINC000100871336
ZINC100871336

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Available files

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