2-[(4-fluorophenyl)methylsulfanyl]-3-(3-nitrophenyl)quinazolin-4-one

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-(3-nitrophenyl)quinazolin-4-one Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-(3-nitrophenyl)quinazolin-4-one CAS Name: 2-[(4-fluorophenyl)methylthio]-3-(3-nitrophenyl)-4-quinazolinone IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-(3-nitrophenyl)quinazolin-4-one Traditional Name: 2-[(4-fluorobenzyl)thio]-3-(3-nitrophenyl)quinazolin-4-one Formula: C21H14FN3O3S MolecularWeight: 407.417563

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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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)F)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14FN3O3S/c22-15-10-8-14(9-11-15)13-29-21-23-19-7-2-1-6-18(19)20(26)24(21)16-4-3-5-17(12-16)25(27)28/h1-12H,13H2