Vitas-M small molecule compound

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

Catalog ID
STK541388
SMILES Clc1cc(Cl)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)N(N=C2c1ccc(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 C23H14Cl2N4O4 MW 481.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14Cl2N4O4/c24-14-10-15(25)12-18(11-14)27-22(30)19-20(13-6-8-17(9-7-13)29(32)33)26-28(21(19)23(27)31)16-4-2-1-3-5-16/h1-12,19,21H/t19-,21+/m1/s1
InChIKey
SUFMMOGATWGVPE-CTNGQTDRSA-N
Synonyms
1014080-03-5
(3aS6aS)5(35dichlorophenyl)3(4nitrophenyl)1phenyl16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)5(35dichlorophenyl)3(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3aS6aS)5(35dichlorophenyl)3(4nitrophenyl)1phenyl3a6adihydropyrrolo(34c)pyrazole46dione
1014080035
C1=CC=C(C=C1)N2C3C(C(=N2)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N(C3=O)C5=CC(=CC(=C5)Cl)Cl
Clc1cc(Cl)cc(c1)N1C(=O)(C@H)2(C@@H)(C1=O)N(N=C2c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC23H14Cl2N4O4c24141015(25)1218(1114)2722(30)1920(136817(9713)29(32)33)2628(21(19)23(27)31)164213516h1121921Ht1921+m1s1
MFCD18241897
ZINC000100906637
ZINC100906637

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Available files

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