Vitas-M small molecule compound
N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-[3-(2-fluoro-4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]-N-(2-methylpropyl)acetamide
Catalog ID
STK936299
SMILES COc1ccc(c(c1)F)c1ccc(=O)n(n1)CC(=O)N(C1CCS(=O)(=O)C1)CC(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 C21H26FN3O5S MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26FN3O5S/c1-14(2)11-24(15-8-9-31(28,29)13-15)21(27)12-25-20(26)7-6-19(23-25)17-5-4-16(30-3)10-18(17)22/h4-7,10,14-15H,8-9,11-13H2,1-3H3InChIKey
PQJYNPCXWHMPOF-UHFFFAOYSA-NSynonyms
1232788-30-51232788305
CC(C)CN(C1CCS(=O)(=O)C1)C(=O)CN2C(=O)C=CC(=N2)C3=C(C=C(C=C3)OC)F
InChI=1SC21H26FN3O5Sc114(2)1124(158931(2829)1315)21(27)122520(26)7619(2325)175416(303)1018(17)22h47101415H891113H213H3
MFCD18067038
N(11dioxidotetrahydrothiophen3yl)2(3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)N(2methylpropyl)acetamide
N(11dioxidotetrahydrothiophen3yl)2(3(2fluoro4methoxyphenyl)6oxopyridazin1(6H)yl)Nisobutylacetamide
N(11dioxothiolan3yl)2(3(2fluoro4methoxyphenyl)6oxopyridazin1yl)N(2methylpropyl)acetamide
ZINC000044901758
ZINC000044901761
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