3-(4-fluorophenyl)-2-[(phenylmethylsulfanyl)methyl]quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(phenylmethylsulfanyl)methyl]quinazolin-4-one Openeye Name: 2-(benzylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[(phenylmethylthio)methyl]-4-quinazolinone IUPAC Name: 2-(benzylsulfanylmethyl)-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(benzylthio)methyl]-3-(4-fluorophenyl)quinazolin-4-one Formula: C22H17FN2OS MolecularWeight: 376.446583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN2OS/c23-17-10-12-18(13-11-17)25-21(15-27-14-16-6-2-1-3-7-16)24-20-9-5-4-8-19(20)22(25)26/h1-13H,14-15H2