6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]purine-2-carbonitrile

Systemtic Name: 6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]purine-2-carbonitrile Openeye Name: 6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]purine-2-carbonitrile CAS Name: 6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]-2-purinecarbonitrile IUPAC Name: 6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]purine-2-carbonitrile Traditional Name: 6-(cyclopentylamino)-9-[2-(phenethylamino)ethyl]purine-2-carbonitrile Formula: C21H25N7 MolecularWeight: 375.4701

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC3=C2N=CN3CCNCCC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC3=C2N=CN3CCNCCC4=CC=CC=C4)C#N

InChI

InChI=1S/C21H25N7/c22-14-18-26-20(25-17-8-4-5-9-17)19-21(27-18)28(15-24-19)13-12-23-11-10-16-6-2-1-3-7-16/h1-3,6-7,15,17,23H,4-5,8-13H2,(H,25,26,27)