8-ethyl-6-phenylsulfanyl-7-prop-2-enyl-purine

Systemtic Name: 8-ethyl-6-phenylsulfanyl-7-prop-2-enyl-purine Openeye Name: 7-allyl-8-ethyl-6-phenylsulfanyl-purine CAS Name: 8-ethyl-6-(phenylthio)-7-prop-2-enylpurine IUPAC Name: 8-ethyl-6-phenylsulfanyl-7-prop-2-enylpurine Traditional Name: 7-allyl-8-ethyl-6-(phenylthio)purine Formula: C16H16N4S MolecularWeight: 296.39004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC=C)C(=NC=N2)SC3=CC=CC=C3

Isomeric SMILES

CCC1=NC2=C(N1CC=C)C(=NC=N2)SC3=CC=CC=C3

InChI

InChI=1S/C16H16N4S/c1-3-10-20-13(4-2)19-15-14(20)16(18-11-17-15)21-12-8-6-5-7-9-12/h3,5-9,11H,1,4,10H2,2H3