Vitas-M small molecule compound
4-(3-nitrophenyl)-2-[2-oxo-2-(pyrrolidin-1-yl)ethyl]phthalazin-1(2H)-one
Catalog ID
STL071444
SMILES O=C(N1CCCC1)Cn1nc(c2cccc(c2)[N+](=O)[O-])c2c(c1=O)cccc2
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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 C20H18N4O4 MW 378.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4/c25-18(22-10-3-4-11-22)13-23-20(26)17-9-2-1-8-16(17)19(21-23)14-6-5-7-15(12-14)24(27)28/h1-2,5-9,12H,3-4,10-11,13H2InChIKey
QSSDRHLLSIWOGK-UHFFFAOYSA-NSynonyms
701224-67-14(3nitrophenyl)2(2oxo2(pyrrolidin1yl)ethyl)phthalazin1(2H)one
4(3NITROPHENYL)2(2OXO2PYRROLIDIN1YLETHYL)PHTHALAZIN1ONE
701224671
C1CCN(C1)C(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC20H18N4O4c2518(2210341122)132320(26)17921816(17)19(2123)1465715(1214)24(27)28h125912H34101113H2
MFCD04190239
O=C(N1CCCC1)Cn1nc(c2cccc(c2)(N+)(=O)(O))c2c(c1=O)cccc2
ZINC000001113212
ZINC01113212
ZINC1113212
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