2-[2-(5-bromanyl-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-[2-(5-bromanyl-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-[3-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C25H17BrF3N3O MolecularWeight: 512.32119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CCC3=CNC4=C3C=C(C=C4)Br)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CCC3=CNC4=C3C=C(C=C4)Br)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C25H17BrF3N3O/c26-17-9-10-21-20(13-17)15(14-30-21)8-11-23-31-22-7-2-1-6-19(22)24(33)32(23)18-5-3-4-16(12-18)25(27,28)29/h1-7,9-10,12-14,30H,8,11H2