4-[1-(6-fluoranyl-4-methyl-quinazolin-2-yl)piperidin-4-yl]carbonyl-3-(4-fluorophenyl)piperazin-2-one

Systemtic Name: 4-[1-(6-fluoranyl-4-methyl-quinazolin-2-yl)piperidin-4-yl]carbonyl-3-(4-fluorophenyl)piperazin-2-one Openeye Name: 4-[1-(6-fluoro-4-methyl-quinazolin-2-yl)piperidine-4-carbonyl]-3-(4-fluorophenyl)piperazin-2-one CAS Name: 4-[[1-(6-fluoro-4-methyl-2-quinazolinyl)-4-piperidinyl]-oxomethyl]-3-(4-fluorophenyl)-2-piperazinone IUPAC Name: 4-[1-(6-fluoro-4-methylquinazolin-2-yl)piperidine-4-carbonyl]-3-(4-fluorophenyl)piperazin-2-one Traditional Name: 4-[1-(6-fluoro-4-methyl-quinazolin-2-yl)isonipecotoyl]-3-(4-fluorophenyl)piperazin-2-one Formula: C25H25F2N5O2 MolecularWeight: 465.495106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCC(CC3)C(=O)N4CCNC(=O)C4C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)F)N3CCC(CC3)C(=O)N4CCNC(=O)C4C5=CC=C(C=C5)F

InChI

InChI=1S/C25H25F2N5O2/c1-15-20-14-19(27)6-7-21(20)30-25(29-15)31-11-8-17(9-12-31)24(34)32-13-10-28-23(33)22(32)16-2-4-18(26)5-3-16/h2-7,14,17,22H,8-13H2,1H3,(H,28,33)