N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide

Systemtic Name: N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Openeye Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[3-(trifluoromethyl)-2-pyridyl]piperidine-3-carboxamide CAS Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[3-(trifluoromethyl)-2-pyridinyl]-3-piperidinecarboxamide IUPAC Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-[3-(trifluoromethyl)pyridin-2-yl]piperidine-3-carboxamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-1-[3-(trifluoromethyl)-2-pyridyl]nipecotamide Formula: C22H22F3N5O2 MolecularWeight: 445.43759

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CCCN(C3)C4=C(C=CC=N4)C(F)(F)F

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CCCN(C3)C4=C(C=CC=N4)C(F)(F)F

InChI

InChI=1S/C22H22F3N5O2/c1-29(13-18-27-17-9-3-2-7-15(17)20(31)28-18)21(32)14-6-5-11-30(12-14)19-16(22(23,24)25)8-4-10-26-19/h2-4,7-10,14H,5-6,11-13H2,1H3,(H,27,28,31)