3-(4-methylphenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 3-(p-tolyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(p-tolyl)-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole Formula: C15H12N6OS MolecularWeight: 324.36038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C15H12N6OS/c1-9-2-4-10(5-3-9)13-20-11(22-21-13)6-23-15-12-14(17-7-16-12)18-8-19-15/h2-5,7-8H,6H2,1H3,(H,16,17,18,19)