Vitas-M small molecule compound
8-[(4-methoxybenzyl)sulfanyl]-9-(4-methylphenyl)-1,9-dihydro-6H-purin-6-one
Catalog ID
STK497063
SMILES COc1ccc(cc1)CSc1nc2c(n1c1ccc(cc1)C)nc[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 C20H18N4O2S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O2S/c1-13-3-7-15(8-4-13)24-18-17(19(25)22-12-21-18)23-20(24)27-11-14-5-9-16(26-2)10-6-14/h3-10,12H,11H2,1-2H3,(H,21,22,25)InChIKey
XZSVGKAEAMDRKL-UHFFFAOYSA-NSynonyms
8((4methoxybenzyl)sulfanyl)9(4methylphenyl)19dihydro6Hpurin6one
8((4methoxyphenyl)methylsulfanyl)9(4methylphenyl)3Hpurin6one
8((4METHOXYPHENYL)METHYLTHIO)9(4METHYLPHENYL)HYDROPURIN6ONE
CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=CC=C(C=C4)OC
COc1ccc(cc1)CSc1nc2c(n1c1ccc(cc1)C)nc(nH)c2=O
InChI=1SC20H18N4O2Sc1133715(8413)241817(19(25)22122118)2320(24)2711145916(262)10614h31012H11H212H3(H212225)
MFCD09788462
ZINC000012462156
ZINC12462156
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