Vitas-M small molecule compound
2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]-N-(3-chloro-4-methoxyphenyl)acetamide
Catalog ID
STL031241
SMILES COc1ccc(cc1Cl)NC(=O)Cn1c(=O)n(Cc2ccc3c(c2)OCO3)c(=O)c2c1ccs2
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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 C23H18ClN3O6S MW 499.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O6S/c1-31-17-5-3-14(9-15(17)24)25-20(28)11-26-16-6-7-34-21(16)22(29)27(23(26)30)10-13-2-4-18-19(8-13)33-12-32-18/h2-9H,10-12H2,1H3,(H,25,28)InChIKey
WPPBQQCZQUTYSY-UHFFFAOYSA-NSynonyms
2(3(13benzodioxol5ylmethyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)N(3chloro4methoxyphenyl)acetamide
2(3(13benzodioxol5ylmethyl)24dioxothieno(32d)pyrimidin1yl)N(3chloro4methoxyphenyl)acetamide
COC1=C(C=C(C=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)CC4=CC5=C(C=C4)OCO5)SC=C3)Cl
InChI=1SC23H18ClN3O6Sc131175314(915(17)24)2520(28)112616673421(16)22(29)27(23(26)30)1013241819(813)33123218h29H1012H21H3(H2528)
MFCD18191305
ZINC000067673617
ZINC67673617
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