2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]ethanamide Openeye Name: 2-[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]acetamide CAS Name: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]acetamide IUPAC Name: 2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]acetamide Traditional Name: 2-[[5-(4-chlorophenyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-[(E)-1-(4-fluorophenyl)ethylideneamino]acetamide Formula: C25H21ClFN5OS MolecularWeight: 493.983543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=C(C)C3=CC=C(C=C3)F)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N/N=C(\C)/C3=CC=C(C=C3)F)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClFN5OS/c1-16-3-13-22(14-4-16)32-24(19-5-9-20(26)10-6-19)30-31-25(32)34-15-23(33)29-28-17(2)18-7-11-21(27)12-8-18/h3-14H,15H2,1-2H3,(H,29,33)/b28-17+