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

Systemtic Name: 9-ethyl-2-(phenylmethylsulfanyl)purin-6-amine Openeye Name: 2-benzylsulfanyl-9-ethyl-purin-6-amine CAS Name: 9-ethyl-2-(phenylmethylthio)-6-purinamine IUPAC Name: 2-benzylsulfanyl-9-ethylpurin-6-amine Traditional Name: [2-(benzylthio)-9-ethyl-purin-6-yl]amine Formula: C14H15N5S MolecularWeight: 285.3674

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2N)SCC3=CC=CC=C3

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2N)SCC3=CC=CC=C3

InChI

InChI=1S/C14H15N5S/c1-2-19-9-16-11-12(15)17-14(18-13(11)19)20-8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,15,17,18)