2-methyl-9-[(1-methylpiperidin-4-yl)methyl]-N,8-diphenyl-purin-6-amine

Systemtic Name: 2-methyl-9-[(1-methylpiperidin-4-yl)methyl]-N,8-diphenyl-purin-6-amine Openeye Name: 2-methyl-9-[(1-methyl-4-piperidyl)methyl]-N,8-diphenyl-purin-6-amine CAS Name: 2-methyl-9-[(1-methyl-4-piperidinyl)methyl]-N,8-diphenyl-6-purinamine IUPAC Name: 2-methyl-9-[(1-methylpiperidin-4-yl)methyl]-N,8-diphenylpurin-6-amine Traditional Name: [2-methyl-9-[(1-methyl-4-piperidyl)methyl]-8-phenyl-purin-6-yl]-phenyl-amine Formula: C25H28N6 MolecularWeight: 412.53002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC3=CC=CC=C3)N=C(N2CC4CCN(CC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C(=N1)NC3=CC=CC=C3)N=C(N2CC4CCN(CC4)C)C5=CC=CC=C5

InChI

InChI=1S/C25H28N6/c1-18-26-23(28-21-11-7-4-8-12-21)22-25(27-18)31(17-19-13-15-30(2)16-14-19)24(29-22)20-9-5-3-6-10-20/h3-12,19H,13-17H2,1-2H3,(H,26,27,28)