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

Systemtic Name: 2-[(4-butyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chlorophenyl)ethanamide Openeye Name: 2-[[4-butyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-chlorophenyl)acetamide CAS Name: 2-[[4-butyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(2-chlorophenyl)acetamide IUPAC Name: 2-[(4-butyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chlorophenyl)acetamide Traditional Name: 2-[[4-butyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(2-chlorophenyl)acetamide Formula: C19H20ClN5OS MolecularWeight: 401.913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2Cl)C3=CN=CC=C3

Isomeric SMILES

CCCCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2Cl)C3=CN=CC=C3

InChI

InChI=1S/C19H20ClN5OS/c1-2-3-11-25-18(14-7-6-10-21-12-14)23-24-19(25)27-13-17(26)22-16-9-5-4-8-15(16)20/h4-10,12H,2-3,11,13H2,1H3,(H,22,26)