[4-[3-(3-fluoranyl-2-methyl-phenyl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanamine

Systemtic Name: [4-[3-(3-fluoranyl-2-methyl-phenyl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanamine Openeye Name: [4-[3-(3-fluoro-2-methyl-phenyl)phenyl]-1-(7H-purin-6-yl)-4-piperidyl]methanamine CAS Name: [4-[3-(3-fluoro-2-methylphenyl)phenyl]-1-(7H-purin-6-yl)-4-piperidinyl]methanamine IUPAC Name: [4-[3-(3-fluoro-2-methylphenyl)phenyl]-1-(7H-purin-6-yl)piperidin-4-yl]methanamine Traditional Name: [4-[3-(3-fluoro-2-methyl-phenyl)phenyl]-1-(7H-purin-6-yl)-4-piperidyl]methylamine Formula: C24H25FN6 MolecularWeight: 416.493903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1F)C2=CC(=CC=C2)C3(CCN(CC3)C4=NC=NC5=C4NC=N5)CN

Isomeric SMILES

CC1=C(C=CC=C1F)C2=CC(=CC=C2)C3(CCN(CC3)C4=NC=NC5=C4NC=N5)CN

InChI

InChI=1S/C24H25FN6/c1-16-19(6-3-7-20(16)25)17-4-2-5-18(12-17)24(13-26)8-10-31(11-9-24)23-21-22(28-14-27-21)29-15-30-23/h2-7,12,14-15H,8-11,13,26H2,1H3,(H,27,28,29,30)