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-butyl-N-methylacetamide
Catalog ID
STL031245
SMILES CCCCN(C(=O)Cn1c(=O)n(Cc2ccc3c(c2)OCO3)c(=O)c2c1ccs2)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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-3-4-8-22(2)18(25)12-23-15-7-9-30-19(15)20(26)24(21(23)27)11-14-5-6-16-17(10-14)29-13-28-16/h5-7,9-10H,3-4,8,11-13H2,1-2H3InChIKey
MVANMCFARXHNCD-UHFFFAOYSA-NSynonyms
2(3(13benzodioxol5ylmethyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)NbutylNmethylacetamide
2(3(13benzodioxol5ylmethyl)24dioxothieno(32d)pyrimidin1yl)NbutylNmethylacetamide
CCCCN(C)C(=O)CN1C2=C(C(=O)N(C1=O)CC3=CC4=C(C=C3)OCO4)SC=C2
InChI=1SC21H23N3O5Sc134822(2)18(25)122315793019(15)20(26)24(21(23)27)1114561617(1014)29132816h57910H3481113H212H3
MFCD18191309
ZINC000057428224
ZINC57428224
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