4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]benzenecarbonitrile Openeye Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]benzonitrile CAS Name: 4-[2-[(4-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]benzonitrile IUPAC Name: 4-[2-[(4-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]benzonitrile Traditional Name: 4-[2-[(4-fluorobenzyl)thio]-4-keto-quinazolin-3-yl]benzonitrile Formula: C22H14FN3OS MolecularWeight: 387.429463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)F)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)F)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H14FN3OS/c23-17-9-5-16(6-10-17)14-28-22-25-20-4-2-1-3-19(20)21(27)26(22)18-11-7-15(13-24)8-12-18/h1-12H,14H2