Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-2-[(3-methoxybenzyl)sulfanyl][1]benzofuro[3,2-d]pyrimidin-4(3H)-one
Catalog ID
STL098527
SMILES COc1cccc(c1)CSc1nc2c(c(=O)n1Cc1ccc3c(c1)OCO3)oc1c2cccc1
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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 C26H20N2O5S MW 472.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O5S/c1-30-18-6-4-5-17(11-18)14-34-26-27-23-19-7-2-3-8-20(19)33-24(23)25(29)28(26)13-16-9-10-21-22(12-16)32-15-31-21/h2-12H,13-15H2,1H3InChIKey
BOJKRRLCMFQINX-UHFFFAOYSA-NSynonyms
1291864-89-51291864895
3(13benzodioxol5ylmethyl)2((3methoxybenzyl)sulfanyl)(1)benzofuro(32d)pyrimidin4(3H)one
3(13benzodioxol5ylmethyl)2((3methoxyphenyl)methylsulfanyl)(1)benzofuro(32d)pyrimidin4one
COC1=CC=CC(=C1)CSC2=NC3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=CC=CC=C63
InChI=1SC26H20N2O5Sc1301864517(1118)143426272319723820(19)3324(23)25(29)28(26)13169102122(1216)32153121h212H1315H21H3
MFCD18789770
ZINC000067259805
ZINC67259805
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