6-(4-fluoranyl-2-methyl-phenyl)-2-(2-methylphenyl)-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one

Systemtic Name: 6-(4-fluoranyl-2-methyl-phenyl)-2-(2-methylphenyl)-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Openeye Name: 6-(4-fluoro-2-methyl-phenyl)-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]-2-(o-tolyl)quinazolin-4-one CAS Name: 6-(4-fluoro-2-methylphenyl)-2-(2-methylphenyl)-3-[[(3S)-1-propan-2-yl-3-piperidinyl]methyl]-4-quinazolinone IUPAC Name: 6-(4-fluoro-2-methylphenyl)-2-(2-methylphenyl)-3-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]quinazolin-4-one Traditional Name: 6-(4-fluoro-2-methyl-phenyl)-3-[[(3S)-1-isopropyl-3-piperidyl]methyl]-2-(o-tolyl)quinazolin-4-one Formula: C31H34FN3O MolecularWeight: 483.619563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)C4=C(C=C(C=C4)F)C)C(=O)N2CC5CCCN(C5)C(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=C(C=C3)C4=C(C=C(C=C4)F)C)C(=O)N2C[C@H]5CCCN(C5)C(C)C

InChI

InChI=1S/C31H34FN3O/c1-20(2)34-15-7-9-23(18-34)19-35-30(27-10-6-5-8-21(27)3)33-29-14-11-24(17-28(29)31(35)36)26-13-12-25(32)16-22(26)4/h5-6,8,10-14,16-17,20,23H,7,9,15,18-19H2,1-4H3/t23-/m0/s1