2-(3-phenylpropylsulfanyl)-9-propyl-purin-6-amine

Systemtic Name: 2-(3-phenylpropylsulfanyl)-9-propyl-purin-6-amine Openeye Name: 2-(3-phenylpropylsulfanyl)-9-propyl-purin-6-amine CAS Name: 2-(3-phenylpropylthio)-9-propyl-6-purinamine IUPAC Name: 2-(3-phenylpropylsulfanyl)-9-propylpurin-6-amine Traditional Name: [2-(3-phenylpropylthio)-9-propyl-purin-6-yl]amine Formula: C17H21N5S MolecularWeight: 327.44714

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N=C2N)SCCCC3=CC=CC=C3

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2N)SCCCC3=CC=CC=C3

InChI

InChI=1S/C17H21N5S/c1-2-10-22-12-19-14-15(18)20-17(21-16(14)22)23-11-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,2,6,9-11H2,1H3,(H2,18,20,21)