3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluorophenyl)propanamide

Systemtic Name: 3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluorophenyl)propanamide Openeye Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluorophenyl)propanamide CAS Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(2-fluorophenyl)propanamide IUPAC Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-fluorophenyl)propanamide Traditional Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(2-fluorophenyl)propionamide Formula: C11H12FN5OS MolecularWeight: 281.309283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCSC2=NNC(=N2)N)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCSC2=NNC(=N2)N)F

InChI

InChI=1S/C11H12FN5OS/c12-7-3-1-2-4-8(7)14-9(18)5-6-19-11-15-10(13)16-17-11/h1-4H,5-6H2,(H,14,18)(H3,13,15,16,17)