2-[3,4-bis(fluoranyl)phenyl]-6-[3-(trifluoromethyl)phenyl]carbonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 2-[3,4-bis(fluoranyl)phenyl]-6-[3-(trifluoromethyl)phenyl]carbonyl-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Openeye Name: 2-(3,4-difluorophenyl)-6-[3-(trifluoromethyl)benzoyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one CAS Name: 2-(3,4-difluorophenyl)-6-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one IUPAC Name: 2-(3,4-difluorophenyl)-6-[3-(trifluoromethyl)benzoyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Traditional Name: 2-(3,4-difluorophenyl)-6-[3-(trifluoromethyl)benzoyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one Formula: C21H14F5N3O2 MolecularWeight: 435.346776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1NC(=NC2=O)C3=CC(=C(C=C3)F)F)C(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CC2=C1NC(=NC2=O)C3=CC(=C(C=C3)F)F)C(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H14F5N3O2/c22-15-5-4-11(9-16(15)23)18-27-17-6-7-29(10-14(17)19(30)28-18)20(31)12-2-1-3-13(8-12)21(24,25)26/h1-5,8-9H,6-7,10H2,(H,27,28,30)