7-methyl-6-(phenylmethylsulfanyl)-8-pyridin-4-yl-purine

Systemtic Name: 7-methyl-6-(phenylmethylsulfanyl)-8-pyridin-4-yl-purine Openeye Name: 6-benzylsulfanyl-7-methyl-8-(4-pyridyl)purine CAS Name: 7-methyl-6-(phenylmethylthio)-8-pyridin-4-ylpurine IUPAC Name: 6-benzylsulfanyl-7-methyl-8-pyridin-4-ylpurine Traditional Name: 6-(benzylthio)-7-methyl-8-(4-pyridyl)purine Formula: C18H15N5S MolecularWeight: 333.4102

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=CN=C2SCC3=CC=CC=C3)N=C1C4=CC=NC=C4

Isomeric SMILES

CN1C2=C(N=CN=C2SCC3=CC=CC=C3)N=C1C4=CC=NC=C4

InChI

InChI=1S/C18H15N5S/c1-23-15-16(22-17(23)14-7-9-19-10-8-14)20-12-21-18(15)24-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3