2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C14H15FN4O2S MolecularWeight: 322.357903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C14H15FN4O2S/c15-10-3-1-9(2-4-10)7-16-12(20)8-22-14-18-17-13(21)19(14)11-5-6-11/h1-4,11H,5-8H2,(H,16,20)(H,17,21)