N-[[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]methyl]-N',N'-dimethyl-propane-1,3-diamine

Systemtic Name: N-[[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]methyl]-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-[[4-[2,6-bis(2-pyridyl)-4-pyridyl]phenyl]methyl]-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-[[4-[2,6-bis(2-pyridinyl)-4-pyridinyl]phenyl]methyl]-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-[[4-(2,6-dipyridin-2-ylpyridin-4-yl)phenyl]methyl]-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[[4-[2,6-bis(2-pyridyl)-4-pyridyl]benzyl]amino]propyl-dimethyl-amine Formula: C27H29N5 MolecularWeight: 423.55266

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNCC1=CC=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

CN(C)CCCNCC1=CC=C(C=C1)C2=CC(=NC(=C2)C3=CC=CC=N3)C4=CC=CC=N4

InChI

InChI=1S/C27H29N5/c1-32(2)17-7-14-28-20-21-10-12-22(13-11-21)23-18-26(24-8-3-5-15-29-24)31-27(19-23)25-9-4-6-16-30-25/h3-6,8-13,15-16,18-19,28H,7,14,17,20H2,1-2H3