2-[1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]ethyl]-1H-quinazolin-4-one Formula: C20H20F3N5O MolecularWeight: 403.40091

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H20F3N5O/c1-13(18-25-16-5-3-2-4-15(16)19(29)26-18)27-8-10-28(11-9-27)17-7-6-14(12-24-17)20(21,22)23/h2-7,12-13H,8-11H2,1H3,(H,25,26,29)