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

Systemtic Name: 2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-pentyl-ethanamide Openeye Name: 2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-pentyl-acetamide CAS Name: 2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-pentylacetamide IUPAC Name: 2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-pentylacetamide Traditional Name: N-amyl-2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NN=C(N1CC)C2=CC=NC=C2

Isomeric SMILES

CCCCCNC(=O)CSC1=NN=C(N1CC)C2=CC=NC=C2

InChI

InChI=1S/C16H23N5OS/c1-3-5-6-9-18-14(22)12-23-16-20-19-15(21(16)4-2)13-7-10-17-11-8-13/h7-8,10-11H,3-6,9,12H2,1-2H3,(H,18,22)