Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(2-phenylethyl)sulfanyl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL098518
SMILES O=c1c2oc3c(c2nc(n1Cc1ccc2c(c1)OCO2)SCCc1ccccc1)cccc3
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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 C26H20N2O4S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O4S/c29-25-24-23(19-8-4-5-9-20(19)32-24)27-26(33-13-12-17-6-2-1-3-7-17)28(25)15-18-10-11-21-22(14-18)31-16-30-21/h1-11,14H,12-13,15-16H2InChIKey
CFGJVXHBGZGRBH-UHFFFAOYSA-NSynonyms
1291836-19-51291836195
3(13benzodioxol5ylmethyl)2((2phenylethyl)sulfanyl)(1)benzofuro(32d)pyrimidin4(3H)one
3(13benzodioxol5ylmethyl)2(2phenylethylsulfanyl)(1)benzofuro(32d)pyrimidin4one
C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C5=CC=CC=C5O4)N=C3SCCC6=CC=CC=C6
InChI=1SC26H20N2O4Sc29252423(19845920(19)3224)2726(331312176213717)28(25)151810112122(1418)31163021h11114H12131516H2
MFCD18789761
ZINC000067259787
ZINC67259787
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