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

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(3-chlorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(3-chlorophenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-(3-chlorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-(3-chlorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H12ClN5OS MolecularWeight: 345.80668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)N2C(=NN=C2SCC(=O)N)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C(=NN=C2SCC(=O)N)C3=CN=CC=C3

InChI

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