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

Systemtic Name: N-(2-methoxyethyl)-2-methyl-9-[(1-methylpiperidin-4-yl)methyl]-8-phenyl-purin-6-amine Openeye Name: N-(2-methoxyethyl)-2-methyl-9-[(1-methyl-4-piperidyl)methyl]-8-phenyl-purin-6-amine CAS Name: N-(2-methoxyethyl)-2-methyl-9-[(1-methyl-4-piperidinyl)methyl]-8-phenyl-6-purinamine IUPAC Name: N-(2-methoxyethyl)-2-methyl-9-[(1-methylpiperidin-4-yl)methyl]-8-phenylpurin-6-amine Traditional Name: 2-methoxyethyl-[2-methyl-9-[(1-methyl-4-piperidyl)methyl]-8-phenyl-purin-6-yl]amine Formula: C22H30N6O MolecularWeight: 394.5132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NCCOC)N=C(N2CC3CCN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NCCOC)N=C(N2CC3CCN(CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C22H30N6O/c1-16-24-20(23-11-14-29-3)19-22(25-16)28(15-17-9-12-27(2)13-10-17)21(26-19)18-7-5-4-6-8-18/h4-8,17H,9-15H2,1-3H3,(H,23,24,25)