4-[(2-chloranyl-9-cyclopentyl-purin-6-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(2-chloranyl-9-cyclopentyl-purin-6-yl)amino]benzenecarbonitrile Openeye Name: 4-[(2-chloro-9-cyclopentyl-purin-6-yl)amino]benzonitrile CAS Name: 4-[(2-chloro-9-cyclopentyl-6-purinyl)amino]benzonitrile IUPAC Name: 4-[(2-chloro-9-cyclopentylpurin-6-yl)amino]benzonitrile Traditional Name: 4-[(2-chloro-9-cyclopentyl-purin-6-yl)amino]benzonitrile Formula: C17H15ClN6 MolecularWeight: 338.7942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=C(C=C4)C#N)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=C(C=C4)C#N)Cl

InChI

InChI=1S/C17H15ClN6/c18-17-22-15(21-12-7-5-11(9-19)6-8-12)14-16(23-17)24(10-20-14)13-3-1-2-4-13/h5-8,10,13H,1-4H2,(H,21,22,23)