3-fluoranyl-N-[(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide

Systemtic Name: 3-fluoranyl-N-[(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 3-fluoro-N-[(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 3-fluoro-N-[[5-(phenacylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 3-fluoro-N-[(5-phenacylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 3-fluoro-N-[[5-(phenacylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C24H19FN4O2S MolecularWeight: 446.496663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H19FN4O2S/c25-19-11-7-10-18(14-19)23(31)26-15-22-27-28-24(29(22)20-12-5-2-6-13-20)32-16-21(30)17-8-3-1-4-9-17/h1-14H,15-16H2,(H,26,31)