Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL031252
SMILES CCC1CCCCN1C(=O)Cn1c2ccsc2c(=O)n(c1=O)Cc1ccc2c(c1)OCO2
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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 C23H25N3O5S MW 455.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O5S/c1-2-16-5-3-4-9-24(16)20(27)13-25-17-8-10-32-21(17)22(28)26(23(25)29)12-15-6-7-18-19(11-15)31-14-30-18/h6-8,10-11,16H,2-5,9,12-14H2,1H3InChIKey
GHALCNIESQXJIB-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)1(2(2ethylpiperidin1yl)2oxoethyl)thieno(32d)pyrimidine24(1H3H)dione
3(13benzodioxol5ylmethyl)1(2(2ethylpiperidin1yl)2oxoethyl)thieno(32d)pyrimidine24dione
CCC1CCCCN1C(=O)CN2C3=C(C(=O)N(C2=O)CC4=CC5=C(C=C4)OCO5)SC=C3
InChI=1SC23H25N3O5Sc1216534924(16)20(27)1325178103221(17)22(28)26(23(25)29)1215671819(1115)31143018h68101116H2591214H21H3
MFCD18191316
ZINC000057428241
ZINC000057428243
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