Vitas-M small molecule compound

methyl 4-({[3-(4-fluoro-2-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}amino)benzoate

Catalog ID
STL155110
SMILES COC(=O)c1ccc(cc1)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1OC)F

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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 C21H18FN3O5 MW 411.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O5/c1-29-18-11-14(22)5-8-16(18)17-9-10-20(27)25(24-17)12-19(26)23-15-6-3-13(4-7-15)21(28)30-2/h3-11H,12H2,1-2H3,(H,23,26)
InChIKey
XMHAXQJEHMOLID-UHFFFAOYSA-N
Synonyms
1246044-89-2
1246044892
COC1=C(C=CC(=C1)F)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC21H18FN3O5c129181114(22)5816(18)1791020(27)25(2417)1219(26)23156313(4715)21(28)302h311H12H212H3(H2326)
methyl4(((3(4fluoro2methoxyphenyl)6oxopyridazin1(6H)yl)acetyl)amino)benzoate
methyl4((2(3(4fluoro2methoxyphenyl)6oxopyridazin1yl)acetyl)amino)benzoate
methyl4(2(3(4fluoro2methoxyphenyl)6oxopyridazin1(6H)yl)acetamido)benzoate
MFCD18069351
ZINC000049549503
ZINC49549503

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Available files

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