N-(2-methylphenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide

Systemtic Name: N-(2-methylphenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Openeye Name: N-(o-tolyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propanamide CAS Name: N-(2-methylphenyl)-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-methylphenyl)-2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propanamide Traditional Name: N-(o-tolyl)-2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]propionamide Formula: C20H23F3N4O MolecularWeight: 392.41803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N4O/c1-14-5-3-4-6-17(14)25-19(28)15(2)26-9-11-27(12-10-26)18-8-7-16(13-24-18)20(21,22)23/h3-8,13,15H,9-12H2,1-2H3,(H,25,28)