Vitas-M small molecule compound
N-(5-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
STL085040
SMILES O=C(Nc1cc(Cl)ccc1C)CSc1nc2c3ccccc3oc2c(=O)n1CC1CCCO1
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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/c1-14-8-9-15(25)11-18(14)26-20(29)13-33-24-27-21-17-6-2-3-7-19(17)32-22(21)23(30)28(24)12-16-5-4-10-31-16/h2-3,6-9,11,16H,4-5,10,12-13H2,1H3,(H,26,29)InChIKey
KPLRDZXTCKZDTF-UHFFFAOYSA-NSynonyms
900002-86-0900002860
CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(C(=O)N2CC4CCCO4)OC5=CC=CC=C53
InChI=1SC24H22ClN3O4Sc1148915(25)1118(14)2620(29)133324272117623719(17)3222(21)23(30)28(24)121654103116h23691116H45101213H21H3(H2629)
MFCD07650719
N(5CHLORO2METHYLPHENYL)2((4OXO3((TETRAHYDROFURAN2YL)METHYL)34DIHYDROBENZOFURO(32D)PYRIMIDIN2YL)THIO)ACETAMIDE
N(5chloro2methylphenyl)2((4oxo3(oxolan2ylmethyl)(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
N(5chloro2methylphenyl)2((4oxo3(tetrahydrofuran2ylmethyl)34dihydro(1)benzofuro(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000009750594
ZINC000009750605
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