2-fluoranyl-N-[[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-fluoranyl-N-[[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 2-fluoro-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 2-fluoro-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2-fluoro-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 2-fluoro-N-[[5-[(4-keto-1H-quinazolin-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C25H19FN6O2S MolecularWeight: 486.520763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=O)C4=CC=CC=C4N3)CNC(=O)C5=CC=CC=C5F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC(=O)C4=CC=CC=C4N3)CNC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C25H19FN6O2S/c26-19-12-6-4-10-17(19)23(33)27-14-22-30-31-25(32(22)16-8-2-1-3-9-16)35-15-21-28-20-13-7-5-11-18(20)24(34)29-21/h1-13H,14-15H2,(H,27,33)(H,28,29,34)