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-cyclohexylacetamide
Catalog ID
STL074363
SMILES O=C(Cn1c(=O)n(Cc2ccc3c(c2)OCO3)c(=O)c2c1ccs2)NC1CCCCC1
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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 C22H23N3O5S MW 441.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O5S/c26-19(23-15-4-2-1-3-5-15)12-24-16-8-9-31-20(16)21(27)25(22(24)28)11-14-6-7-17-18(10-14)30-13-29-17/h6-10,15H,1-5,11-13H2,(H,23,26)InChIKey
RCOULOOOEJNZOF-UHFFFAOYSA-NSynonyms
2(3(13benzodioxol5ylmethyl)24dioxo34dihydrothieno(32d)pyrimidin1(2H)yl)Ncyclohexylacetamide
2(3(13benzodioxol5ylmethyl)24dioxothieno(32d)pyrimidin1yl)Ncyclohexylacetamide
C1CCC(CC1)NC(=O)CN2C3=C(C(=O)N(C2=O)CC4=CC5=C(C=C4)OCO5)SC=C3
InChI=1SC22H23N3O5Sc2619(23154213515)122416893120(16)21(27)25(22(24)28)1114671718(1014)30132917h61015H151113H2(H2326)
MFCD18195757
ZINC000057486455
ZINC57486455
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