N-[2-[(1-pyridin-2-ylpyrrolidin-3-yl)amino]pyridin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[(1-pyridin-2-ylpyrrolidin-3-yl)amino]pyridin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[[1-(2-pyridyl)pyrrolidin-3-yl]amino]-3-pyridyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[[1-(2-pyridinyl)-3-pyrrolidinyl]amino]-3-pyridinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[(1-pyridin-2-ylpyrrolidin-3-yl)amino]pyridin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[[1-(2-pyridyl)pyrrolidin-3-yl]amino]-3-pyridyl]-3-(trifluoromethyl)benzamide Formula: C22H20F3N5O MolecularWeight: 427.42231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC2=C(C=CC=N2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=N4

Isomeric SMILES

C1CN(CC1NC2=C(C=CC=N2)NC(=O)C3=CC(=CC=C3)C(F)(F)F)C4=CC=CC=N4

InChI

InChI=1S/C22H20F3N5O/c23-22(24,25)16-6-3-5-15(13-16)21(31)29-18-7-4-11-27-20(18)28-17-9-12-30(14-17)19-8-1-2-10-26-19/h1-8,10-11,13,17H,9,12,14H2,(H,27,28)(H,29,31)