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

Systemtic Name: 2-fluoranyl-N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]benzamide Openeye Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)-2-fluoro-benzamide CAS Name: 2-fluoro-N-[3-(phenylmethylthio)-1H-1,2,4-triazol-5-yl]benzamide IUPAC Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)-2-fluorobenzamide Traditional Name: N-[3-(benzylthio)-1H-1,2,4-triazol-5-yl]-2-fluoro-benzamide Formula: C16H13FN4OS MolecularWeight: 328.364023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NNC(=N2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NNC(=N2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C16H13FN4OS/c17-13-9-5-4-8-12(13)14(22)18-15-19-16(21-20-15)23-10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,19,20,21,22)