Vitas-M small molecule compound
4-[(E)-{[3-(dimethylamino)propyl]imino}methyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK741756
SMILES CN(CCC/N=C/c1c([nH]n(c1=O)c1ccc(cc1)[N+](=O)[O-])c1ccccc1)C
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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 C21H23N5O3 MW 393.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3/c1-24(2)14-6-13-22-15-19-20(16-7-4-3-5-8-16)23-25(21(19)27)17-9-11-18(12-10-17)26(28)29/h3-5,7-12,15,23H,6,13-14H2,1-2H3/b22-15+InChIKey
HJXNWAVBSFVLTK-PXLXIMEGSA-NSynonyms
371950-05-9(E)4(((3(dimethylamino)propyl)imino)methyl)2(4nitrophenyl)5phenyl1Hpyrazol3(2H)one
371950059
4((E)((3(dimethylamino)propyl)imino)methyl)2(4nitrophenyl)5phenyl12dihydro3Hpyrazol3one
CN(CCCN=Cc1c((nH)n(c1=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1)C
MFCD01811062
ZINC000100256993
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