Vitas-M small molecule compound
8-(benzylsulfanyl)-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497075
SMILES Cc1ccc(cc1)n1c(SCc2ccccc2)nc2c1nc[nH]c2=O
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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 C19H16N4OS MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4OS/c1-13-7-9-15(10-8-13)23-17-16(18(24)21-12-20-17)22-19(23)25-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,20,21,24)InChIKey
BTLIHYNQLWCQQI-UHFFFAOYSA-NSynonyms
8(benzylsulfanyl)9(4methylphenyl)19dihydro6Hpurin6one
8benzylsulfanyl9(4methylphenyl)3Hpurin6one
CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=CC=CC=C4
Cc1ccc(cc1)n1c(SCc2ccccc2)nc2c1nc(nH)c2=O
InChI=1SC19H16N4OSc1137915(10813)231716(18(24)21122017)2219(23)2511145324614h21012H11H21H3(H202124)
MFCD11854596
ZINC000020394366
ZINC20394366
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