Vitas-M small molecule compound
2,2-dimethyl-1-[(1S,2R,3S,10bR)-1-nitro-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazin-3-yl]propan-1-one
Catalog ID
STK554151
SMILES [O-][N+](=O)[C@@H]1[C@H]2c3ccccc3C=NN2[C@@H]([C@H]1c1ccccc1)C(=O)C(C)(C)C
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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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c1-22(2,3)21(26)20-17(14-9-5-4-6-10-14)19(25(27)28)18-16-12-8-7-11-15(16)13-23-24(18)20/h4-13,17-20H,1-3H3/t17-,18+,19-,20-/m0/s1InChIKey
UWYRDNCOMXXPNJ-YRPNKDGESA-NSynonyms
958955-86-7(O)(N+)(=O)(C@@H)1(C@H)2c3ccccc3C=NN2(C@@H)((C@H)1c1ccccc1)C(=O)C(C)(C)C
1((1S2R3S10bR)1nitro2phenyl12310btetrahydropyrrolo(21a)phthalazin3yl)22dimethylpropan1one
22dimethyl1((1S2R3S10bR)1nitro2phenyl12310btetrahydropyrrolo(21a)phthalazin3yl)propan1one
958955867
CC(C)(C)C(=O)C1C(C(C2N1N=CC3=CC=CC=C23)(N+)(=O)(O))C4=CC=CC=C4
InChI=1SC22H23N3O3c122(23)21(26)2017(1495461014)19(25(27)28)181612871115(16)132324(18)20h4131720H13H3t1718+1920m0s1
MFCD18242774
ZINC000005092768
ZINC05092768
ZINC5092768
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