Vitas-M small molecule compound
6-hydroxy-3-methyl-7-(3-phenylpropyl)-8-(phenylsulfanyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STL047129
SMILES O=c1nc(O)c2c(n1C)nc(n2CCCc1ccccc1)Sc1ccccc1
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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 C21H20N4O2S MW 392.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O2S/c1-24-18-17(19(26)23-20(24)27)25(14-8-11-15-9-4-2-5-10-15)21(22-18)28-16-12-6-3-7-13-16/h2-7,9-10,12-13H,8,11,14H2,1H3,(H,23,26,27)InChIKey
ZODGRTGODVOMON-UHFFFAOYSA-NSynonyms
673489-97-93METHYL7(3PHENYLPROPYL)8(PHENYLTHIO)1HPURINE26(3H7H)DIONE
3METHYL7(3PHENYLPROPYL)8PHENYLSULFANYLPURINE26DIONE
3METHYL7(3PHENYLPROPYL)8PHENYLTHIO137TRIHYDROPURINE26DIONE
673489979
6hydroxy3methyl7(3phenylpropyl)8(phenylsulfanyl)37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)SC3=CC=CC=C3)CCCC4=CC=CC=C4
InChI=1SC21H20N4O2Sc1241817(19(26)2320(24)27)25(148111594251015)21(2218)2816126371316h279101213H81114H21H3(H232627)
MFCD04072536
ZINC000001262374
ZINC01262374
ZINC1262374
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