3-(4-fluorophenyl)-2-[(2-fluorophenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(2-fluorophenyl)methylsulfanyl]-7-piperidin-1-ylcarbonyl-quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[(2-fluorophenyl)methylsulfanyl]-7-(piperidine-1-carbonyl)quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[(2-fluorophenyl)methylthio]-7-[oxo(1-piperidinyl)methyl]-4-quinazolinone IUPAC Name: 3-(4-fluorophenyl)-2-[(2-fluorophenyl)methylsulfanyl]-7-(piperidine-1-carbonyl)quinazolin-4-one Traditional Name: 2-[(2-fluorobenzyl)thio]-3-(4-fluorophenyl)-7-(piperidine-1-carbonyl)quinazolin-4-one Formula: C27H23F2N3O2S MolecularWeight: 491.552226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=CC=C4F)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=N3)SCC4=CC=CC=C4F)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H23F2N3O2S/c28-20-9-11-21(12-10-20)32-26(34)22-13-8-18(25(33)31-14-4-1-5-15-31)16-24(22)30-27(32)35-17-19-6-2-3-7-23(19)29/h2-3,6-13,16H,1,4-5,14-15,17H2