Vitas-M small molecule compound

N-[2-(3,4-dimethylphenyl)-6-methyl-5-oxo-4-phenyl-2,5-dihydropyridazin-3-yl]-4-nitrobenzamide

Catalog ID
STK585349
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1n(nc(c(=O)c1c1ccccc1)C)c1ccc(c(c1)C)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 C26H22N4O4 MW 454.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O4/c1-16-9-12-22(15-17(16)2)29-25(27-26(32)20-10-13-21(14-11-20)30(33)34)23(24(31)18(3)28-29)19-7-5-4-6-8-19/h4-15H,1-3H3,(H,27,32)
InChIKey
IYJIJPCFRGAHSX-UHFFFAOYSA-N
Synonyms
899390-49-9
899390499
CC1=C(C=C(C=C1)N2C(=C(C(=O)C(=N2)C)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O))C
InChI=1SC26H22N4O4c11691222(1517(16)2)2925(2726(32)20101321(141120)30(33)34)23(24(31)18(3)2829)197546819h415H13H3(H2732)
MFCD06610281
N(2(34dimethylphenyl)6methyl5oxo4phenyl25dihydropyridazin3yl)4nitrobenzamide
N(2(34DIMETHYLPHENYL)6METHYL5OXO4PHENYLPYRIDAZIN3YL)4NITROBENZAMIDE
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1n(nc(c(=O)c1c1ccccc1)C)c1ccc(c(c1)C)C
ZINC000002348372
ZINC02348372
ZINC2348372

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.