Vitas-M small molecule compound
2-[(3-butyl-4-oxo-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide
Catalog ID
STL084934
SMILES CCCCn1c(SCC(=O)Nc2cccc(c2C)Cl)nc2c(c1=O)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 C23H22ClN3O3S MW 455.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3S/c1-3-4-12-27-22(29)21-20(15-8-5-6-11-18(15)30-21)26-23(27)31-13-19(28)25-17-10-7-9-16(24)14(17)2/h5-11H,3-4,12-13H2,1-2H3,(H,25,28)InChIKey
MXSQQDPZIGMINB-UHFFFAOYSA-NSynonyms
899982-23-12((3butyl4oxo(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(3chloro2methylphenyl)acetamide
2((3butyl4oxo34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)N(3chloro2methylphenyl)acetamide
2((3BUTYL4OXO34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)N(3CHLORO2METHYLPHENYL)ACETAMIDE
899982231
CCCCN1C(=O)C2=C(C3=CC=CC=C3O2)N=C1SCC(=O)NC4=C(C(=CC=C4)Cl)C
InChI=1SC23H22ClN3O3Sc134122722(29)2120(158561118(15)3021)2623(27)311319(28)2517107916(24)14(17)2h511H341213H212H3(H2528)
MFCD07650628
ZINC000009749603
ZINC09749603
ZINC9749603
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