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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-(4-fluorophenyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-ethyl-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-N-(4-fluorophenyl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-ethyl-N-(4-fluorophenyl)acetamide Formula: C12H14FN5OS MolecularWeight: 295.335863

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CCN(C1=CC=C(C=C1)F)C(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C12H14FN5OS/c1-2-18(9-5-3-8(13)4-6-9)10(19)7-20-12-15-11(14)16-17-12/h3-6H,2,7H2,1H3,(H3,14,15,16,17)