Vitas-M small molecule compound

methyl 4-{[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]methyl}benzoate

Catalog ID
STK358927
SMILES COC(=O)c1ccc(cc1)Cn1nc(ccc1=O)c1ccc(cc1)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 C20H18N2O3 MW 334.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O3/c1-14-3-7-16(8-4-14)18-11-12-19(23)22(21-18)13-15-5-9-17(10-6-15)20(24)25-2/h3-12H,13H2,1-2H3
InChIKey
ZSMWPZWVMKSUID-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC3=CC=C(C=C3)C(=O)OC
InChI=1SC20H18N2O3c1143716(8414)18111219(23)22(2118)13155917(10615)20(24)252h312H13H212H3
methyl4((3(4methylphenyl)6oxopyridazin1(6H)yl)methyl)benzoate
methyl4((3(4methylphenyl)6oxopyridazin1yl)methyl)benzoate
MFCD11852251
ZINC000006767152
ZINC06767152
ZINC6767152

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Available files

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