Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-1-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]thieno[3,2-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL031230
SMILES O=C(N1CCCc2c1cccc2)Cn1c(=O)n(Cc2ccc3c(c2)OCO3)c(=O)c2c1ccs2
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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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c29-22(26-10-3-5-17-4-1-2-6-18(17)26)14-27-19-9-11-34-23(19)24(30)28(25(27)31)13-16-7-8-20-21(12-16)33-15-32-20/h1-2,4,6-9,11-12H,3,5,10,13-15H2InChIKey
ZOWFUTFVCCUPBT-UHFFFAOYSA-NSynonyms
3(13benzodioxol5ylmethyl)1(2(34dihydro2Hquinolin1yl)2oxoethyl)thieno(32d)pyrimidine24dione
3(13benzodioxol5ylmethyl)1(2(34dihydroquinolin1(2H)yl)2oxoethyl)thieno(32d)pyrimidine24(1H3H)dione
C1CC2=CC=CC=C2N(C1)C(=O)CN3C4=C(C(=O)N(C3=O)CC5=CC6=C(C=C5)OCO6)SC=C4
InChI=1SC25H21N3O5Sc2922(26103517412618(17)26)1427199113423(19)24(30)28(25(27)31)1316782021(1216)33153220h124691112H35101315H2
MFCD18191294
ZINC000067673601
ZINC67673601
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