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

Systemtic Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)pentanamide Openeye Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)pentanamide CAS Name: N-[(3-fluorophenyl)methylthio]-N-(1H-1,2,4-triazol-5-yl)pentanamide IUPAC Name: N-[(3-fluorophenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)pentanamide Traditional Name: N-[(3-fluorobenzyl)thio]-N-(1H-1,2,4-triazol-5-yl)valeramide Formula: C14H17FN4OS MolecularWeight: 308.374383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17FN4OS/c1-2-3-7-13(20)19(14-16-10-17-18-14)21-9-11-5-4-6-12(15)8-11/h4-6,8,10H,2-3,7,9H2,1H3,(H,16,17,18)