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

Systemtic Name: 9-ethyl-8-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-3H-purin-6-one Openeye Name: 9-ethyl-8-[(5-methyl-2-phenyl-oxazol-4-yl)methylsulfanyl]-3H-purin-6-one CAS Name: 9-ethyl-8-[(5-methyl-2-phenyl-4-oxazolyl)methylthio]-3H-purin-6-one IUPAC Name: 9-ethyl-8-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-3H-purin-6-one Traditional Name: 9-ethyl-8-[(5-methyl-2-phenyl-oxazol-4-yl)methylthio]-3H-purin-6-one Formula: C18H17N5O2S MolecularWeight: 367.42488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)N=CN2)N=C1SCC3=C(OC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CCN1C2=C(C(=O)N=CN2)N=C1SCC3=C(OC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C18H17N5O2S/c1-3-23-15-14(16(24)20-10-19-15)22-18(23)26-9-13-11(2)25-17(21-13)12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3,(H,19,20,24)