N3-[[5-(1H-indol-6-yl)-2-(pyridin-4-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine

Systemtic Name: N3-[[5-(1H-indol-6-yl)-2-(pyridin-4-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine Openeye Name: N3-[[5-(1H-indol-6-yl)-2-(4-pyridylmethoxy)phenyl]methyl]pyridine-2,3-diamine CAS Name: N3-[[5-(1H-indol-6-yl)-2-(pyridin-4-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine IUPAC Name: 3-N-[[5-(1H-indol-6-yl)-2-(pyridin-4-ylmethoxy)phenyl]methyl]pyridine-2,3-diamine Traditional Name: (2-amino-3-pyridyl)-[5-(1H-indol-6-yl)-2-(4-pyridylmethoxy)benzyl]amine Formula: C26H23N5O MolecularWeight: 421.49372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N)NCC2=C(C=CC(=C2)C3=CC4=C(C=C3)C=CN4)OCC5=CC=NC=C5

Isomeric SMILES

C1=CC(=C(N=C1)N)NCC2=C(C=CC(=C2)C3=CC4=C(C=C3)C=CN4)OCC5=CC=NC=C5

InChI

InChI=1S/C26H23N5O/c27-26-23(2-1-10-30-26)31-16-22-14-20(21-4-3-19-9-13-29-24(19)15-21)5-6-25(22)32-17-18-7-11-28-12-8-18/h1-15,29,31H,16-17H2,(H2,27,30)