Vitas-M small molecule compound
3-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-6-chloro-4-phenylquinolin-2(1H)-one
Catalog ID
STK001670
SMILES Clc1ccc2c(c1)c(c1ccccc1)c(c(=O)[nH]2)Sc1nc(C)c(c(n1)O)Cc1ccccc1
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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 C27H20ClN3O2S MW 485.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O2S/c1-16-20(14-17-8-4-2-5-9-17)25(32)31-27(29-16)34-24-23(18-10-6-3-7-11-18)21-15-19(28)12-13-22(21)30-26(24)33/h2-13,15H,14H2,1H3,(H,30,33)(H,29,31,32)InChIKey
WOTDBNCMHNQEOI-UHFFFAOYSA-NSynonyms
3((5BENZYL4HYDROXY6METHYLPYRIMIDIN2YL)SULFANYL)6CHLORO4PHENYLQUINOLIN2(1H)ONE
3((5BENZYL6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)6CHLORO4PHENYL1HQUINOLIN2ONE
3(5BENZYL4HYDROXY6METHYLPYRIMIDIN2YLTHIO)6CHLORO4PHENYLQUINOLIN2(1H)ONE
CC1=C(C(=O)N=C(N1)SC2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)CC5=CC=CC=C5
Clc1ccc2c(c1)c(c1ccccc1)c(c(=O)(nH)2)Sc1nc(C)c(c(n1)O)Cc1ccccc1
InChI=1SC27H20ClN3O2Sc11620(14178425917)25(32)3127(2916)342423(18106371118)211519(28)121322(21)3026(24)33h21315H14H21H3(H3033)(H293132)
MFCD03194840
STK001670
ZINC000013517250
ZINC13517250
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