2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(4-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(4-fluorophenyl)quinazolin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-(4-fluorophenyl)-4-quinazolinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-(4-fluorophenyl)quinazolin-4-one Formula: C22H14FN3OS2 MolecularWeight: 419.494463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H14FN3OS2/c23-14-9-11-15(12-10-14)26-21(27)16-5-1-2-6-17(16)25-22(26)28-13-20-24-18-7-3-4-8-19(18)29-20/h1-12H,13H2