Vitas-M small molecule compound

methyl 2-({[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)benzoate

Catalog ID
STK853587
SMILES COC(=O)c1ccccc1NC(=O)c1nn(ccc1=O)c1cccc(c1)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 C20H17N3O4 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O4/c1-13-6-5-7-14(12-13)23-11-10-17(24)18(22-23)19(25)21-16-9-4-3-8-15(16)20(26)27-2/h3-12H,1-2H3,(H,21,25)
InChIKey
UFEPEXWPAZBZPG-UHFFFAOYSA-N
Synonyms
874206-58-3
874206583
CC1=CC(=CC=C1)N2C=CC(=O)C(=N2)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC20H17N3O4c11365714(1213)23111017(24)18(2223)19(25)2116943815(16)20(26)272h312H12H3(H2125)
METHYL2(((1(3METHYLPHENYL)4OXO14DIHYDRO3PYRIDAZINYL)CARBONYL)AMINO)BENZOATE
methyl2(((1(3methylphenyl)4oxo14dihydropyridazin3yl)carbonyl)amino)benzoate
METHYL2((1(3METHYLPHENYL)4OXOPYRIDAZINE3CARBONYL)AMINO)BENZOATE
methyl2(4oxo1(mtolyl)14dihydropyridazine3carboxamido)benzoate
MFCD07427867
ZINC000006747749
ZINC06747749
ZINC6747749

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Available files

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