Vitas-M small molecule compound
7-(2-chlorobenzyl)-6-hydroxy-3-methyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-3,7-dihydro-2H-purin-2-one
Catalog ID
STL037947
SMILES CC(=C)CSc1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C
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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 C17H17ClN4O2S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2S/c1-10(2)9-25-17-19-14-13(15(23)20-16(24)21(14)3)22(17)8-11-6-4-5-7-12(11)18/h4-7H,1,8-9H2,2-3H3,(H,20,23,24)InChIKey
HMQFTMSDQJDGNO-UHFFFAOYSA-NSynonyms
378203-12-4378203124
7((2CHLOROPHENYL)METHYL)3METHYL8(2METHYLPROP2ENYLSULFANYL)PURINE26DIONE
7((2CHLOROPHENYL)METHYL)3METHYL8(2METHYLPROP2ENYLTHIO)137TRIHYDROPURINE26DIONE
7(2CHLOROBENZYL)3METHYL8((2METHYLALLYL)THIO)1HPURINE26(3H7H)DIONE
7(2chlorobenzyl)6hydroxy3methyl8((2methylprop2en1yl)sulfanyl)37dihydro2Hpurin2one
CC(=C)CSC1=NC2=C(N1CC3=CC=CC=C3Cl)C(=O)NC(=O)N2C
InChI=1SC17H17ClN4O2Sc110(2)92517191413(15(23)2016(24)21(14)3)22(17)811645712(11)18h47H189H223H3(H202324)
MFCD03793525
ZINC000000638092
ZINC00638092
ZINC638092
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