3-pentyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinazoline-2,4-dione

Systemtic Name: 3-pentyl-7-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-1H-quinazoline-2,4-dione Openeye Name: 3-pentyl-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazoline-2,4-dione CAS Name: 7-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-3-pentyl-1H-quinazoline-2,4-dione IUPAC Name: 3-pentyl-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazoline-2,4-dione Traditional Name: 3-amyl-7-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]-1H-quinazoline-2,4-quinone Formula: C25H27F3N4O3 MolecularWeight: 488.50209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)NC1=O

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)NC1=O

InChI

InChI=1S/C25H27F3N4O3/c1-2-3-4-10-32-23(34)20-9-8-17(15-21(20)29-24(32)35)22(33)31-13-11-30(12-14-31)19-7-5-6-18(16-19)25(26,27)28/h5-9,15-16H,2-4,10-14H2,1H3,(H,29,35)