N-butyl-2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-ethanamide

Systemtic Name: N-butyl-2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-ethanamide Openeye Name: N-butyl-2-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-acetamide CAS Name: N-butyl-2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methylacetamide IUPAC Name: N-butyl-2-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methylacetamide Traditional Name: N-butyl-2-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-acetamide Formula: C15H19ClN4OS MolecularWeight: 338.85556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCN(C)C(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H19ClN4OS/c1-3-4-9-19(2)13(21)10-20-14(17-18-15(20)22)11-5-7-12(16)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H,18,22)