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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC1=NN=C(N1C)SCC2=CC=C(C=C2)F

Isomeric SMILES

CCC(=O)NCC1=NN=C(N1C)SCC2=CC=C(C=C2)F

InChI

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