N3-[[5-pyridin-3-yl-2-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]pyridine-2,3-diamine

Systemtic Name: N3-[[5-pyridin-3-yl-2-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]pyridine-2,3-diamine Openeye Name: N3-[[5-(3-pyridyl)-2-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]pyridine-2,3-diamine CAS Name: N3-[[5-(3-pyridinyl)-2-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]pyridine-2,3-diamine IUPAC Name: 3-N-[[5-pyridin-3-yl-2-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]pyridine-2,3-diamine Traditional Name: (2-amino-3-pyridyl)-[5-(3-pyridyl)-2-(2-pyrrolidinoethoxy)benzyl]amine Formula: C23H27N5O MolecularWeight: 389.49338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=C(C=C(C=C2)C3=CN=CC=C3)CNC4=C(N=CC=C4)N

Isomeric SMILES

C1CCN(C1)CCOC2=C(C=C(C=C2)C3=CN=CC=C3)CNC4=C(N=CC=C4)N

InChI

InChI=1S/C23H27N5O/c24-23-21(6-4-10-26-23)27-17-20-15-18(19-5-3-9-25-16-19)7-8-22(20)29-14-13-28-11-1-2-12-28/h3-10,15-16,27H,1-2,11-14,17H2,(H2,24,26)