N-[4-chloranyl-2-(trifluoromethyl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-[4-chloranyl-2-(trifluoromethyl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C18H19ClF3N5O MolecularWeight: 413.82457

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)C(F)(F)F)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H19ClF3N5O/c1-12(26-7-9-27(10-8-26)17-23-5-2-6-24-17)16(28)25-15-4-3-13(19)11-14(15)18(20,21)22/h2-6,11-12H,7-10H2,1H3,(H,25,28)