N-(3-azanylpropyl)-6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxamide

Systemtic Name: N-(3-azanylpropyl)-6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-6-[[1,2,2-tris(2-pyridyl)ethylamino]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-6-[[1,2,2-tris(2-pyridinyl)ethylamino]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-6-[(1,2,2-tripyridin-2-ylethylamino)methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-6-[[1,2,2-tris(2-pyridyl)ethylamino]methyl]nicotinamide Formula: C27H29N7O MolecularWeight: 467.56546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(C2=CC=CC=N2)C(C3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)NCCCN

Isomeric SMILES

C1=CC=NC(=C1)C(C2=CC=CC=N2)C(C3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)NCCCN

InChI

InChI=1S/C27H29N7O/c28-13-7-17-32-27(35)20-11-12-21(33-18-20)19-34-26(24-10-3-6-16-31-24)25(22-8-1-4-14-29-22)23-9-2-5-15-30-23/h1-6,8-12,14-16,18,25-26,34H,7,13,17,19,28H2,(H,32,35)