Vitas-M small molecule compound
2-(4-nitrophenoxy)-1-[4-(4-phenylphthalazin-1-yl)piperazin-1-yl]ethanone
Catalog ID
STK263794
SMILES O=C(N1CCN(CC1)c1nnc(c2c1cccc2)c1ccccc1)COc1ccc(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 C26H23N5O4 MW 469.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O4/c32-24(18-35-21-12-10-20(11-13-21)31(33)34)29-14-16-30(17-15-29)26-23-9-5-4-8-22(23)25(27-28-26)19-6-2-1-3-7-19/h1-13H,14-18H2InChIKey
PVJUCSOYEJNSRU-UHFFFAOYSA-NSynonyms
672332-75-12(4nitrophenoxy)1(4(4phenylphthalazin1yl)piperazin1yl)ethanone
672332751
C1CN(CCN1C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C(=O)COC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC26H23N5O4c3224(183521121020(111321)31(33)34)29141630(171529)2623954822(23)25(272826)196213719h113H1418H2
MFCD04008954
O=C(N1CCN(CC1)c1nnc(c2c1cccc2)c1ccccc1)COc1ccc(cc1)(N+)(=O)(O)
ZINC000009489256
ZINC9489256
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