8-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one

Systemtic Name: 8-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one Openeye Name: 8-[[5-methyl-2-(m-tolyl)oxazol-4-yl]methylsulfanyl]-9-(p-tolyl)-3H-purin-6-one CAS Name: 8-[[5-methyl-2-(3-methylphenyl)-4-oxazolyl]methylthio]-9-(4-methylphenyl)-3H-purin-6-one IUPAC Name: 8-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]-9-(4-methylphenyl)-3H-purin-6-one Traditional Name: 8-[[5-methyl-2-(m-tolyl)oxazol-4-yl]methylthio]-9-(p-tolyl)-3H-purin-6-one Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=C(OC(=N4)C5=CC(=CC=C5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=O)N=CN3)N=C2SCC4=C(OC(=N4)C5=CC(=CC=C5)C)C

InChI

InChI=1S/C24H21N5O2S/c1-14-7-9-18(10-8-14)29-21-20(22(30)26-13-25-21)28-24(29)32-12-19-16(3)31-23(27-19)17-6-4-5-15(2)11-17/h4-11,13H,12H2,1-3H3,(H,25,26,30)