Vitas-M small molecule compound

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

Catalog ID
STK542260
SMILES O=C1[C@@H]2C(=NN([C@@H]2C(=O)N1c1ccccc1F)c1ccccc1)c1ccc(cc1)[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 C23H15FN4O4 MW 430.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15FN4O4/c24-17-8-4-5-9-18(17)26-22(29)19-20(14-10-12-16(13-11-14)28(31)32)25-27(21(19)23(26)30)15-6-2-1-3-7-15/h1-13,19,21H/t19-,21+/m1/s1
InChIKey
NHZSZGDVBIEKJZ-CTNGQTDRSA-N
Synonyms
957004-04-5
(3aS6aS)5(2fluorophenyl)3(4nitrophenyl)1phenyl16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)5(2fluorophenyl)3(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)5(2fluorophenyl)3(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46dione
957004045
C1=CC=C(C=C1)N2C3C(C(=N2)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N(C3=O)C5=CC=CC=C5F
InChI=1SC23H15FN4O4c2417845918(17)2622(29)1920(14101216(131114)28(31)32)2527(21(19)23(26)30)156213715h1131921Ht1921+m1s1
MFCD18241979
O=C1(C@@H)2C(=NN((C@@H)2C(=O)N1c1ccccc1F)c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
ZINC000100830545
ZINC100830545

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Available files

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