4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]benzamide

Systemtic Name: 4-[[2-[(4-azanylcyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]benzamide Openeye Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]benzamide CAS Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-6-purinyl]amino]benzamide IUPAC Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentylpurin-6-yl]amino]benzamide Traditional Name: 4-[[2-[(4-aminocyclohexyl)amino]-9-cyclopentyl-purin-6-yl]amino]benzamide Formula: C23H30N8O MolecularWeight: 434.5373

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=C(C=C4)C(=O)N)NC5CCC(CC5)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NC4=CC=C(C=C4)C(=O)N)NC5CCC(CC5)N

InChI

InChI=1S/C23H30N8O/c24-15-7-11-17(12-8-15)28-23-29-21(27-16-9-5-14(6-10-16)20(25)32)19-22(30-23)31(13-26-19)18-3-1-2-4-18/h5-6,9-10,13,15,17-18H,1-4,7-8,11-12,24H2,(H2,25,32)(H2,27,28,29,30)