2-(phenylmethylsulfanyl)-7H-purine

Systemtic Name: 2-(phenylmethylsulfanyl)-7H-purine Openeye Name: 2-benzylsulfanyl-7H-purine CAS Name: 2-(phenylmethylthio)-7H-purine IUPAC Name: 2-benzylsulfanyl-7H-purine Traditional Name: 2-(benzylthio)-7H-purine Formula: C12H10N4S MolecularWeight: 242.2996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C3C(=N2)N=CN3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C3C(=N2)N=CN3

InChI

InChI=1S/C12H10N4S/c1-2-4-9(5-3-1)7-17-12-13-6-10-11(16-12)15-8-14-10/h1-6,8H,7H2,(H,13,14,15,16)