Vitas-M small molecule compound
methyl N-{[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}valinate
Catalog ID
STL425421
SMILES COC(=O)C(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1F)OC
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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 C19H22FN3O5 MW 391.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22FN3O5/c1-11(2)18(19(26)28-4)21-16(24)10-23-17(25)8-7-15(22-23)13-6-5-12(27-3)9-14(13)20/h5-9,11,18H,10H2,1-4H3,(H,21,24)InChIKey
QRHBPIMNXOYXGA-UHFFFAOYSA-NSynonyms
(S)methyl2(2(3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)acetamido)3methylbutanoate
CC(C)C(C(=O)OC)NC(=O)CN1C(=O)C=CC(=N1)C2=C(C=C(C=C2)OC)F
COC(=O)(C@H)(C(C)C)NC(=O)Cn1nc(ccc1=O)c1ccc(cc1F)OC
InChI=1SC19H22FN3O5c111(2)18(19(26)284)2116(24)102317(25)8715(2223)136512(273)914(13)20h591118H10H214H3(H2124)
methyl2((2(3(2fluoro4methoxyphenyl)6oxopyridazin1yl)acetyl)amino)3methylbutanoate
methylN((3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)acetyl)valinate
MFCD30709976
ZINC000218256299
ZINC000252497816
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