Vitas-M small molecule compound
2-[3-(3,5-difluorophenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(4-methoxybenzyl)acetamide
Catalog ID
STL031678
SMILES COc1ccc(cc1)CNC(=O)Cn1c2ccsc2c(=O)n(c1=O)c1cc(F)cc(c1)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 C22H17F2N3O4S MW 457.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F2N3O4S/c1-31-17-4-2-13(3-5-17)11-25-19(28)12-26-18-6-7-32-20(18)21(29)27(22(26)30)16-9-14(23)8-15(24)10-16/h2-10H,11-12H2,1H3,(H,25,28)InChIKey
ZKMUKTRHAAHQFD-UHFFFAOYSA-NSynonyms
2(3(35difluorophenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)N(4methoxybenzyl)acetamide
2(3(35difluorophenyl)24dioxothieno(32d)pyrimidin1yl)N((4methoxyphenyl)methyl)acetamide
COC1=CC=C(C=C1)CNC(=O)CN2C3=C(C(=O)N(C2=O)C4=CC(=CC(=C4)F)F)SC=C3
InChI=1SC22H17F2N3O4Sc131174213(3517)112519(28)122618673220(18)21(29)27(22(26)30)16914(23)815(24)1016h210H1112H21H3(H2528)
MFCD18191708
ZINC000057429068
ZINC57429068
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