3-[4-[(2S)-butan-2-yl]phenyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-3-[4-[(1S)-1-methylpropyl]phenyl]quinazolin-4-one CAS Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[(2-fluorophenyl)methylthio]-4-quinazolinone IUPAC Name: 3-[4-[(2S)-butan-2-yl]phenyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 2-[(2-fluorobenzyl)thio]-3-[4-[(1S)-1-methylpropyl]phenyl]quinazolin-4-one Formula: C25H23FN2OS MolecularWeight: 418.526323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4F

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4F

InChI

InChI=1S/C25H23FN2OS/c1-3-17(2)18-12-14-20(15-13-18)28-24(29)21-9-5-7-11-23(21)27-25(28)30-16-19-8-4-6-10-22(19)26/h4-15,17H,3,16H2,1-2H3/t17-/m0/s1