Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-[(3-butyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL029862
SMILES CCCCn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nc2c(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 C20H21N3O4S2 MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S2/c1-2-3-7-23-19(25)18-14(6-8-28-18)22-20(23)29-11-17(24)21-10-13-4-5-15-16(9-13)27-12-26-15/h4-6,8-9H,2-3,7,10-12H2,1H3,(H,21,24)InChIKey
OAOWESKQVRSELZ-UHFFFAOYSA-NSynonyms
1252843-42-71252843427
CCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NCC3=CC4=C(C=C3)OCO4
InChI=1SC20H21N3O4S2c12372319(25)1814(682818)2220(23)291117(24)211013451516(913)27122615h4689H2371012H21H3(H2124)
MFCD18190138
N(13benzodioxol5ylmethyl)2((3butyl4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetamide
N(13benzodioxol5ylmethyl)2(3butyl4oxothieno(32d)pyrimidin2yl)sulfanylacetamide
ZINC000057426417
ZINC57426417
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