N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)butanamide

Systemtic Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)butanamide Openeye Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)butanamide CAS Name: N-[(3-fluorophenyl)methylthio]-N-(1H-1,2,4-triazol-5-yl)butanamide IUPAC Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)butanamide Traditional Name: N-[(3-fluorobenzyl)thio]-N-(1H-1,2,4-triazol-5-yl)butyramide Formula: C13H15FN4OS MolecularWeight: 294.347803

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=NC=NN1)SCC2=CC(=CC=C2)F

Isomeric SMILES

CCCC(=O)N(C1=NC=NN1)SCC2=CC(=CC=C2)F

InChI

InChI=1S/C13H15FN4OS/c1-2-4-12(19)18(13-15-9-16-17-13)20-8-10-5-3-6-11(14)7-10/h3,5-7,9H,2,4,8H2,1H3,(H,15,16,17)