Vitas-M small molecule compound
N-(3-chloro-2-methylphenyl)-2-{[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-3,4-dihydro[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL085059
SMILES O=C(Nc1cccc(c1C)Cl)CSc1nc2c(c(=O)n1CC1CCCO1)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 C24H22ClN3O4S MW 483.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClN3O4S/c1-14-17(25)8-4-9-18(14)26-20(29)13-33-24-27-21-16-7-2-3-10-19(16)32-22(21)23(30)28(24)12-15-6-5-11-31-15/h2-4,7-10,15H,5-6,11-13H2,1H3,(H,26,29)InChIKey
FRQHWWXRSHXYAO-UHFFFAOYSA-NSynonyms
899942-04-2899942042
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC24H22ClN3O4Sc11417(25)84918(14)2620(29)1333242721167231019(16)3222(21)23(30)28(24)121565113115h2471015H561113H21H3(H2629)
MFCD07650737
N(3CHLORO2METHYLPHENYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(3chloro2methylphenyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009750965
ZINC000009750972
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