6-(phenylmethylsulfanyl)-9-propyl-purin-2-amine

Systemtic Name: 6-(phenylmethylsulfanyl)-9-propyl-purin-2-amine Openeye Name: 6-benzylsulfanyl-9-propyl-purin-2-amine CAS Name: 6-(phenylmethylthio)-9-propyl-2-purinamine IUPAC Name: 6-benzylsulfanyl-9-propylpurin-2-amine Traditional Name: [6-(benzylthio)-9-propyl-purin-2-yl]amine Formula: C15H17N5S MolecularWeight: 299.39398

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N=C2SCC3=CC=CC=C3)N

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2SCC3=CC=CC=C3)N

InChI

InChI=1S/C15H17N5S/c1-2-8-20-10-17-12-13(20)18-15(16)19-14(12)21-9-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H2,16,18,19)