N1-[5-(4-chloranyl-3-fluoranyl-phenyl)-4-pyridin-4-yl-pyridin-2-yl]-3-phenyl-propane-1,2-diamine

Systemtic Name: N1-[5-(4-chloranyl-3-fluoranyl-phenyl)-4-pyridin-4-yl-pyridin-2-yl]-3-phenyl-propane-1,2-diamine Openeye Name: N1-[5-(4-chloro-3-fluoro-phenyl)-4-(4-pyridyl)-2-pyridyl]-3-phenyl-propane-1,2-diamine CAS Name: N1-[5-(4-chloro-3-fluorophenyl)-4-pyridin-4-yl-2-pyridinyl]-3-phenylpropane-1,2-diamine IUPAC Name: 1-N-[5-(4-chloro-3-fluorophenyl)-4-pyridin-4-ylpyridin-2-yl]-3-phenylpropane-1,2-diamine Traditional Name: (2-amino-3-phenyl-propyl)-[5-(4-chloro-3-fluoro-phenyl)-4-(4-pyridyl)-2-pyridyl]amine Formula: C25H22ClFN4 MolecularWeight: 432.920383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CNC2=NC=C(C(=C2)C3=CC=NC=C3)C4=CC(=C(C=C4)Cl)F)N

Isomeric SMILES

C1=CC=C(C=C1)CC(CNC2=NC=C(C(=C2)C3=CC=NC=C3)C4=CC(=C(C=C4)Cl)F)N

InChI

InChI=1S/C25H22ClFN4/c26-23-7-6-19(13-24(23)27)22-16-31-25(14-21(22)18-8-10-29-11-9-18)30-15-20(28)12-17-4-2-1-3-5-17/h1-11,13-14,16,20H,12,15,28H2,(H,30,31)