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

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorophenyl)butanamide IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)butanamide Traditional Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorophenyl)butyramide Formula: C14H17FN4OS MolecularWeight: 308.374383

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NN=C(N2C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NN=C(N2C)C

InChI

InChI=1S/C14H17FN4OS/c1-4-12(21-14-18-17-9(2)19(14)3)13(20)16-11-7-5-10(15)6-8-11/h5-8,12H,4H2,1-3H3,(H,16,20)