Vitas-M small molecule compound
4-(4-ethylphenyl)-2-[2-nitro-5-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Catalog ID
STK022486
SMILES CCc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCCC1
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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/c1-2-18-9-11-19(12-10-18)25-21-7-3-4-8-22(21)26(31)29(27-25)24-17-20(28-15-5-6-16-28)13-14-23(24)30(32)33/h3-4,7-14,17H,2,5-6,15-16H2,1H3InChIKey
GFROHRDCJBOYAI-UHFFFAOYSA-NSynonyms
4(4ETHYLPHENYL)2(2NITRO5(PYRROLIDIN1YL)PHENYL)PHTHALAZIN1(2H)ONE
4(4ETHYLPHENYL)2(2NITRO5PYRROLIDIN1YLPHENYL)PHTHALAZIN1ONE
4(4ETHYLPHENYL)2(2NITRO5PYRROLIDINYLPHENYL)2HYDROPHTHALAZIN1ONE
CCC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=CC(=C4)N5CCCC5)(N+)(=O)(O)
CCc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1(N+)(=O)(O))N1CCCC1
InChI=1SC26H24N4O3c121891119(121018)2521734822(21)26(31)29(2725)241720(2815561628)131423(24)30(32)33h3471417H2561516H21H3
MFCD00607420
STK022486
ZINC000008781224
ZINC08781224
ZINC8781224
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