6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentylsulfanyl]-7H-purine

Systemtic Name: 6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentylsulfanyl]-7H-purine Openeye Name: 6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentylsulfanyl]-7H-purine CAS Name: 6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)thio]pentylthio]-7H-purine IUPAC Name: 6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]pentylsulfanyl]-7H-purine Traditional Name: 6-[5-[(4,5-diphenyl-1H-imidazol-2-yl)thio]pentylthio]-7H-purine Formula: C25H24N6S2 MolecularWeight: 472.62826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCCCSC3=NC=NC4=C3NC=N4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCCCSC3=NC=NC4=C3NC=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6S2/c1-4-10-18(11-5-1)20-21(19-12-6-2-7-13-19)31-25(30-20)33-15-9-3-8-14-32-24-22-23(27-16-26-22)28-17-29-24/h1-2,4-7,10-13,16-17H,3,8-9,14-15H2,(H,30,31)(H,26,27,28,29)