Vitas-M small molecule compound
[(1S,2R,3S)-2-(furan-2-yl)-1-nitro-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl](phenyl)methanone
Catalog ID
STK544797
SMILES O=C([C@H]1N2N=Cc3c(C2[C@H]([C@@H]1c1ccco1)[N+](=O)[O-])cccc3)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 C22H17N3O4 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4/c26-22(14-7-2-1-3-8-14)21-18(17-11-6-12-29-17)20(25(27)28)19-16-10-5-4-9-15(16)13-23-24(19)21/h1-13,18-21H/t18-,19?,20-,21-/m0/s1InChIKey
GYTQWQDOZABPNL-JMESPPODSA-NSynonyms
956814-01-0((1S2R3S)2(furan2yl)1nitro12310btetrahydropyrrolo(21a)phthalazin3yl)(phenyl)methanone
((1S2R3S)2(furan2yl)1nitro12310btetrahydropyrrolo(21a)phthalazin3yl)phenylmethanone
956814010
C1=CC=C(C=C1)C(=O)C2C(C(C3N2N=CC4=CC=CC=C34)(N+)(=O)(O))C5=CC=CO5
InChI=1SC22H17N3O4c2622(147213814)2118(17116122917)20(25(27)28)19161054915(16)132324(19)21h1131821Ht1819?2021m0s1
MFCD18242175
O=C((C@H)1N2N=Cc3c(C2(C@H)((C@@H)1c1ccco1)(N+)(=O)(O))cccc3)c1ccccc1
ZINC000004886841
ZINC000004886847
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