1-[(4-azanylpyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]-3-[bis(pyridin-2-ylmethyl)amino]propan-2-ol

Systemtic Name: 1-[(4-azanylpyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]-3-[bis(pyridin-2-ylmethyl)amino]propan-2-ol Openeye Name: 1-[(4-amino-2-pyridyl)methyl-(2-pyridylmethyl)amino]-3-[bis(2-pyridylmethyl)amino]propan-2-ol CAS Name: 1-[(4-amino-2-pyridinyl)methyl-(2-pyridinylmethyl)amino]-3-[bis(2-pyridinylmethyl)amino]-2-propanol IUPAC Name: 1-[(4-aminopyridin-2-yl)methyl-(pyridin-2-ylmethyl)amino]-3-[bis(pyridin-2-ylmethyl)amino]propan-2-ol Traditional Name: 1-[(4-amino-2-pyridyl)methyl-(2-pyridylmethyl)amino]-3-[bis(2-pyridylmethyl)amino]propan-2-ol Formula: C27H31N7O MolecularWeight: 469.58134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)CC(CN(CC3=CC=CC=N3)CC4=NC=CC(=C4)N)O

Isomeric SMILES

C1=CC=NC(=C1)CN(CC2=CC=CC=N2)CC(CN(CC3=CC=CC=N3)CC4=NC=CC(=C4)N)O

InChI

InChI=1S/C27H31N7O/c28-22-10-14-32-26(15-22)19-34(18-25-9-3-6-13-31-25)21-27(35)20-33(16-23-7-1-4-11-29-23)17-24-8-2-5-12-30-24/h1-15,27,35H,16-21H2,(H2,28,32)