2-fluoranyl-N-[[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 2-fluoranyl-N-[[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: N-[(4-benzyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-fluorobenzamide Traditional Name: N-[(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]-2-fluoro-benzamide Formula: C17H15FN4OS MolecularWeight: 342.390603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NNC2=S)CNC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NNC2=S)CNC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C17H15FN4OS/c18-14-9-5-4-8-13(14)16(23)19-10-15-20-21-17(24)22(15)11-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,19,23)(H,21,24)