Vitas-M small molecule compound
2-({[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}methyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Catalog ID
STL143421
SMILES O=c1c2sccc2nc(n1Cc1ccc2c(c1)OCO2)SCc1cc(=O)n2c(n1)cccc2
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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 C23H16N4O4S2 MW 476.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O4S2/c28-20-10-15(24-19-3-1-2-7-26(19)20)12-33-23-25-16-6-8-32-21(16)22(29)27(23)11-14-4-5-17-18(9-14)31-13-30-17/h1-10H,11-13H2InChIKey
BKHPTJWVOZGTID-UHFFFAOYSA-NSynonyms
2(((3(13benzodioxol5ylmethyl)4oxo34dihydrothieno(32d)pyrimidin2yl)sulfanyl)methyl)4Hpyrido(12a)pyrimidin4one
3(13BENZODIOXOL5YLMETHYL)2((4OXOPYRIDO(12A)PYRIMIDIN2YL)METHYLSULFANYL)THIENO(32D)PYRIMIDIN4ONE
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=CS4)N=C3SCC5=CC(=O)N6C=CC=CC6=N5
InChI=1SC23H16N4O4S2c28201015(2419312726(19)20)1233232516683221(16)22(29)27(23)1114451718(914)31133017h110H1113H2
MFCD03018738
ZINC000002909083
ZINC2909083
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