Vitas-M small molecule compound
N-(5-chloro-2-methylphenyl)-2-[6-methyl-3-(2-methylpropyl)-2-(methylsulfanyl)-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetamide
Catalog ID
STL111622
SMILES CSc1nc2cc(n(c2c(=O)n1CC(C)C)CC(=O)Nc1cc(Cl)ccc1C)C
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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 C21H25ClN4O2S MW 432.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN4O2S/c1-12(2)10-26-20(28)19-17(24-21(26)29-5)8-14(4)25(19)11-18(27)23-16-9-15(22)7-6-13(16)3/h6-9,12H,10-11H2,1-5H3,(H,23,27)InChIKey
KIDIFFFARXCRNZ-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)Cl)NC(=O)CN2C(=CC3=C2C(=O)N(C(=N3)SC)CC(C)C)C
InChI=1SC21H25ClN4O2Sc112(2)102620(28)1917(2421(26)295)814(4)25(19)1118(27)2316915(22)7613(16)3h6912H1011H215H3(H2327)
MFCD20746503
N(5chloro2methylphenyl)2(6methyl3(2methylpropyl)2(methylsulfanyl)4oxo34dihydro5Hpyrrolo(32d)pyrimidin5yl)acetamide
N(5chloro2methylphenyl)2(6methyl3(2methylpropyl)2methylsulfanyl4oxopyrrolo(32d)pyrimidin5yl)acetamide
ZINC000067319956
ZINC67319956
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