N-[[4-methoxy-3-(9-methylpurin-6-yl)phenyl]methyl]-1-(4-methylphenyl)ethanamine

Systemtic Name: N-[[4-methoxy-3-(9-methylpurin-6-yl)phenyl]methyl]-1-(4-methylphenyl)ethanamine Openeye Name: N-[[4-methoxy-3-(9-methylpurin-6-yl)phenyl]methyl]-1-(p-tolyl)ethanamine CAS Name: N-[[4-methoxy-3-(9-methyl-6-purinyl)phenyl]methyl]-1-(4-methylphenyl)ethanamine IUPAC Name: N-[[4-methoxy-3-(9-methylpurin-6-yl)phenyl]methyl]-1-(4-methylphenyl)ethanamine Traditional Name: [4-methoxy-3-(9-methylpurin-6-yl)benzyl]-[1-(p-tolyl)ethyl]amine Formula: C23H25N5O MolecularWeight: 387.4775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NCC2=CC(=C(C=C2)OC)C3=C4C(=NC=N3)N(C=N4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NCC2=CC(=C(C=C2)OC)C3=C4C(=NC=N3)N(C=N4)C

InChI

InChI=1S/C23H25N5O/c1-15-5-8-18(9-6-15)16(2)24-12-17-7-10-20(29-4)19(11-17)21-22-23(26-13-25-21)28(3)14-27-22/h5-11,13-14,16,24H,12H2,1-4H3