6-phenethylsulfanyl-9-propyl-purin-2-amine

Systemtic Name: 6-phenethylsulfanyl-9-propyl-purin-2-amine Openeye Name: 6-phenethylsulfanyl-9-propyl-purin-2-amine CAS Name: 6-(phenethylthio)-9-propyl-2-purinamine IUPAC Name: 6-phenethylsulfanyl-9-propylpurin-2-amine Traditional Name: [6-(phenethylthio)-9-propyl-purin-2-yl]amine Formula: C16H19N5S MolecularWeight: 313.42056

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N=C2SCCC3=CC=CC=C3)N

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2SCCC3=CC=CC=C3)N

InChI

InChI=1S/C16H19N5S/c1-2-9-21-11-18-13-14(21)19-16(17)20-15(13)22-10-8-12-6-4-3-5-7-12/h3-7,11H,2,8-10H2,1H3,(H2,17,19,20)