Vitas-M small molecule compound
4-(4-methylphenyl)-2-[2-nitro-5-(pyrrolidin-1-yl)phenyl]phthalazin-1(2H)-one
Catalog ID
STK157989
SMILES Cc1ccc(cc1)c1nn(c2cc(ccc2[N+](=O)[O-])N2CCCC2)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 C25H22N4O3 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3/c1-17-8-10-18(11-9-17)24-20-6-2-3-7-21(20)25(30)28(26-24)23-16-19(27-14-4-5-15-27)12-13-22(23)29(31)32/h2-3,6-13,16H,4-5,14-15H2,1H3InChIKey
UIEWXQNCAGSOEF-UHFFFAOYSA-NSynonyms
591726-36-22(2nitro5(pyrrolidin1yl)phenyl)4(ptolyl)phthalazin1(2H)one
4(4METHYLPHENYL)2(2NITRO5(PYRROLIDIN1YL)PHENYL)PHTHALAZIN1(2H)ONE
4(4METHYLPHENYL)2(2NITRO5PYRROLIDIN1YLPHENYL)PHTHALAZIN1ONE
591726362
CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=C(C=CC(=C4)N5CCCC5)(N+)(=O)(O)
Cc1ccc(cc1)c1nn(c2cc(ccc2(N+)(=O)(O))N2CCCC2)c(=O)c2c1cccc2
InChI=1SC25H22N4O3c11781018(11917)2420623721(20)25(30)28(2624)231619(2714451527)121322(23)29(31)32h2361316H451415H21H3
MFCD03694938
ZINC000009068577
ZINC09068577
ZINC9068577
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