7-(cyclohexylmethyl)-9-phenyl-2-phenylazanyl-purin-8-one

Systemtic Name: 7-(cyclohexylmethyl)-9-phenyl-2-phenylazanyl-purin-8-one Openeye Name: 2-anilino-7-(cyclohexylmethyl)-9-phenyl-purin-8-one CAS Name: 2-anilino-7-(cyclohexylmethyl)-9-phenyl-8-purinone IUPAC Name: 2-anilino-7-(cyclohexylmethyl)-9-phenylpurin-8-one Traditional Name: 2-anilino-7-(cyclohexylmethyl)-9-phenyl-purin-8-one Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)NC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CN2C3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C24H25N5O/c30-24-28(17-18-10-4-1-5-11-18)21-16-25-23(26-19-12-6-2-7-13-19)27-22(21)29(24)20-14-8-3-9-15-20/h2-3,6-9,12-16,18H,1,4-5,10-11,17H2,(H,25,26,27)