2-[[4-azanyl-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide

Systemtic Name: 2-[[4-azanyl-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide Openeye Name: 2-[[4-amino-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3,4-trifluorophenyl)acetamide CAS Name: 2-[[4-amino-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2,3,4-trifluorophenyl)acetamide IUPAC Name: 2-[[4-amino-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3,4-trifluorophenyl)acetamide Traditional Name: 2-[[4-amino-5-(3-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2,3,4-trifluorophenyl)acetamide Formula: C16H11F4N5OS MolecularWeight: 397.350053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C2=NN=C(N2N)SCC(=O)NC3=C(C(=C(C=C3)F)F)F

Isomeric SMILES

C1=CC(=CC(=C1)F)C2=NN=C(N2N)SCC(=O)NC3=C(C(=C(C=C3)F)F)F

InChI

InChI=1S/C16H11F4N5OS/c17-9-3-1-2-8(6-9)15-23-24-16(25(15)21)27-7-12(26)22-11-5-4-10(18)13(19)14(11)20/h1-6H,7,21H2,(H,22,26)