Vitas-M small molecule compound
4-(3,4-dimethylphenyl)-2-[5-nitro-2-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Catalog ID
STK032196
SMILES Cc1cc(ccc1C)c1nn(c2cc(ccc2N2CCCC2)[N+](=O)[O-])c(=O)c2c1cccc2
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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 C26H24N4O3 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O3/c1-17-9-10-19(15-18(17)2)25-21-7-3-4-8-22(21)26(31)29(27-25)24-16-20(30(32)33)11-12-23(24)28-13-5-6-14-28/h3-4,7-12,15-16H,5-6,13-14H2,1-2H3InChIKey
RPPYDZGXBHJLSC-UHFFFAOYSA-NSynonyms
4(34DIMETHYLPHENYL)2(5NITRO2(PYRROLIDIN1YL)PHENYL)PHTHALAZIN1(2H)ONE
4(34DIMETHYLPHENYL)2(5NITRO2PYRROLIDIN1YLPHENYL)PHTHALAZIN1ONE
4(34DIMETHYLPHENYL)2(5NITRO2PYRROLIDINYLPHENYL)2HYDROPHTHALAZIN1ONE
CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=CC(=C4)(N+)(=O)(O))N5CCCC5)C
Cc1cc(ccc1C)c1nn(c2cc(ccc2N2CCCC2)(N+)(=O)(O))c(=O)c2c1cccc2
InChI=1SC26H24N4O3c11791019(1518(17)2)2521734822(21)26(31)29(2725)241620(30(32)33)111223(24)2813561428h347121516H561314H212H3
MFCD01173863
STK032196
ZINC000009041355
ZINC09041355
ZINC9041355
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