Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[3-(2-methoxyphenyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide
Catalog ID
STL077366
SMILES COc1ccccc1n1c(=O)n(CC(=O)Nc2ccc3c(c2)OCO3)c2c(c1=O)scc2
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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 C22H17N3O6S MW 451.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O6S/c1-29-16-5-3-2-4-14(16)25-21(27)20-15(8-9-32-20)24(22(25)28)11-19(26)23-13-6-7-17-18(10-13)31-12-30-17/h2-10H,11-12H2,1H3,(H,23,26)InChIKey
VWMSTFHMOWJBRD-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1N2C(=O)C3=C(C=CS3)N(C2=O)CC(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC22H17N3O6Sc12916532414(16)2521(27)2015(893220)24(22(25)28)1119(26)2313671718(1013)31123017h210H1112H21H3(H2326)
MFCD18198593
N(13benzodioxol5yl)2(3(2methoxyphenyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)acetamide
N(13benzodioxol5yl)2(3(2methoxyphenyl)24dioxothieno(32d)pyrimidin1yl)acetamide
ZINC000057490867
ZINC57490867
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