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

Systemtic Name: N-butyl-2-[[5-(2-chlorophenyl)-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-butyl-2-[[5-(2-chlorophenyl)-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-butyl-2-[[5-(2-chlorophenyl)-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-butyl-2-[[5-(2-chlorophenyl)-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-butyl-2-[[5-(2-chlorophenyl)-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H20ClFN4OS MolecularWeight: 418.915403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2F)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCNC(=O)CSC1=NN=C(N1C2=CC=CC=C2F)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClFN4OS/c1-2-3-12-23-18(27)13-28-20-25-24-19(14-8-4-5-9-15(14)21)26(20)17-11-7-6-10-16(17)22/h4-11H,2-3,12-13H2,1H3,(H,23,27)