9-[1-[[4-(3-phenyl-1,8-naphthyridin-2-yl)phenyl]methyl]piperidin-4-yl]purin-6-amine

Systemtic Name: 9-[1-[[4-(3-phenyl-1,8-naphthyridin-2-yl)phenyl]methyl]piperidin-4-yl]purin-6-amine Openeye Name: 9-[1-[[4-(3-phenyl-1,8-naphthyridin-2-yl)phenyl]methyl]-4-piperidyl]purin-6-amine CAS Name: 9-[1-[[4-(3-phenyl-1,8-naphthyridin-2-yl)phenyl]methyl]-4-piperidinyl]-6-purinamine IUPAC Name: 9-[1-[[4-(3-phenyl-1,8-naphthyridin-2-yl)phenyl]methyl]piperidin-4-yl]purin-6-amine Traditional Name: [9-[1-[4-(3-phenyl-1,8-naphthyridin-2-yl)benzyl]-4-piperidyl]purin-6-yl]amine Formula: C31H28N8 MolecularWeight: 512.60762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=C2N=CN=C3N)CC4=CC=C(C=C4)C5=C(C=C6C=CC=NC6=N5)C7=CC=CC=C7

Isomeric SMILES

C1CN(CCC1N2C=NC3=C2N=CN=C3N)CC4=CC=C(C=C4)C5=C(C=C6C=CC=NC6=N5)C7=CC=CC=C7

InChI

InChI=1S/C31H28N8/c32-29-28-31(35-19-34-29)39(20-36-28)25-12-15-38(16-13-25)18-21-8-10-23(11-9-21)27-26(22-5-2-1-3-6-22)17-24-7-4-14-33-30(24)37-27/h1-11,14,17,19-20,25H,12-13,15-16,18H2,(H2,32,34,35)