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

Systemtic Name: N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide Openeye Name: N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-propanamide CAS Name: N-[[5-[(4-fluorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methylpropanamide IUPAC Name: N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methylpropanamide Traditional Name: N-[[5-[(4-fluorobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl]-2-methyl-propionamide Formula: C15H19FN4OS MolecularWeight: 322.400963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19FN4OS/c1-10(2)14(21)17-8-13-18-19-15(20(13)3)22-9-11-4-6-12(16)7-5-11/h4-7,10H,8-9H2,1-3H3,(H,17,21)