Vitas-M small molecule compound
ethyl 3-({[(3-ethyl-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL085228
SMILES CCOC(=O)c1cccc(c1)NC(=O)CSc1nc2c3ccccc3oc2c(=O)n1CC
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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 C23H21N3O5S MW 451.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5S/c1-3-26-21(28)20-19(16-10-5-6-11-17(16)31-20)25-23(26)32-13-18(27)24-15-9-7-8-14(12-15)22(29)30-4-2/h5-12H,3-4,13H2,1-2H3,(H,24,27)InChIKey
JBIOKRIPUPIJON-UHFFFAOYSA-NSynonyms
CCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NC4=CC=CC(=C4)C(=O)OCC
ethyl3((((3ethyl4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
ethyl3((2((3ethyl4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
InChI=1SC23H21N3O5Sc132621(28)2019(1610561117(16)3120)2523(26)321318(27)241597814(1215)22(29)3042h512H3413H212H3(H2427)
MFCD18203356
ZINC000057523195
ZINC57523195
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