6-[1-(2-chlorophenyl)ethylsulfonylsulfanyl]-7H-purine

Systemtic Name: 6-[1-(2-chlorophenyl)ethylsulfonylsulfanyl]-7H-purine Openeye Name: 6-[1-(2-chlorophenyl)ethylsulfonylsulfanyl]-7H-purine CAS Name: 6-[1-(2-chlorophenyl)ethylsulfonylthio]-7H-purine IUPAC Name: 6-[1-(2-chlorophenyl)ethylsulfonylsulfanyl]-7H-purine Traditional Name: 6-[1-(2-chlorophenyl)ethylsulfonylthio]-7H-purine Formula: C13H11ClN4O2S2 MolecularWeight: 354.83504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)S(=O)(=O)SC2=NC=NC3=C2NC=N3

Isomeric SMILES

CC(C1=CC=CC=C1Cl)S(=O)(=O)SC2=NC=NC3=C2NC=N3

InChI

InChI=1S/C13H11ClN4O2S2/c1-8(9-4-2-3-5-10(9)14)22(19,20)21-13-11-12(16-6-15-11)17-7-18-13/h2-8H,1H3,(H,15,16,17,18)