Vitas-M small molecule compound
2-(4-nitrophenyl)-9-phenyltetrahydro-5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione
Catalog ID
STK536479
SMILES O=C1C2N3CCCN3C(C2C(=O)N1c1ccc(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 C20H18N4O4 MW 378.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4/c25-19-16-17(13-5-2-1-3-6-13)21-11-4-12-22(21)18(16)20(26)23(19)14-7-9-15(10-8-14)24(27)28/h1-3,5-10,16-18H,4,11-12H2InChIKey
OISCIFNOFLVLJI-UHFFFAOYSA-NSynonyms
2(4nitrophenyl)9phenylhexahydro1Hpyrazolo(12a)pyrrolo(34c)pyrazole13(2H)dione
2(4nitrophenyl)9phenyltetrahydro5Hpyrazolo(12a)pyrrolo(34c)pyrazole13(2H3aH)dione
C1CN2C(C3C(N2C1)C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=CC=C5
InChI=1SC20H18N4O4c25191617(135213613)211141222(21)18(16)20(26)23(19)147915(10814)24(27)28h135101618H41112H2
MFCD02223352
O=C1C2N3CCCN3C(C2C(=O)N1c1ccc(cc1)(N+)(=O)(O))c1ccccc1
ZINC000100568148
ZINC000239377979
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