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

Systemtic Name: 3-phenyl-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 3-phenyl-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 3-phenyl-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 3-phenyl-5-(7H-purin-6-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 3-phenyl-5-[(7H-purin-6-ylthio)methyl]-1,2,4-oxadiazole Formula: C14H10N6OS MolecularWeight: 310.3338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N6OS/c1-2-4-9(5-3-1)12-19-10(21-20-12)6-22-14-11-13(16-7-15-11)17-8-18-14/h1-5,7-8H,6H2,(H,15,16,17,18)