2-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[[2,5-bis(fluoranyl)phenyl]methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[(2,5-difluorophenyl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(2,5-difluorophenyl)methylthio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[(2,5-difluorophenyl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-benzyl-2-[(2,5-difluorobenzyl)thio]quinazolin-4-one Formula: C22H16F2N2OS MolecularWeight: 394.437046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)F)F

InChI

InChI=1S/C22H16F2N2OS/c23-17-10-11-19(24)16(12-17)14-28-22-25-20-9-5-4-8-18(20)21(27)26(22)13-15-6-2-1-3-7-15/h1-12H,13-14H2