2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-N-(isobutylcarbamoyl)propanamide CAS Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]-N-(isobutylcarbamoyl)propionamide Formula: C18H25ClF3N5O2 MolecularWeight: 435.87161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)N1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C18H25ClF3N5O2/c1-11(2)9-24-17(29)25-16(28)12(3)26-4-6-27(7-5-26)15-14(19)8-13(10-23-15)18(20,21)22/h8,10-12H,4-7,9H2,1-3H3,(H2,24,25,28,29)