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

Systemtic Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-2-yl-ethanamide Openeye Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-pyridyl)acetamide CAS Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2-pyridinyl)acetamide IUPAC Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pyridin-2-ylacetamide Traditional Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2-pyridyl)acetamide Formula: C15H12ClN5OS MolecularWeight: 345.80668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=O)CSC2=NN=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)NC(=O)CSC2=NN=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H12ClN5OS/c16-11-4-3-5-12(8-11)21-10-18-20-15(21)23-9-14(22)19-13-6-1-2-7-17-13/h1-8,10H,9H2,(H,17,19,22)