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

Systemtic Name: N-hexyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-hexyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-hexyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-hexyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-hexyl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C15H21N5OS MolecularWeight: 319.42514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NNC(=N1)C2=CC=NC=C2

Isomeric SMILES

CCCCCCNC(=O)CSC1=NNC(=N1)C2=CC=NC=C2

InChI

InChI=1S/C15H21N5OS/c1-2-3-4-5-8-17-13(21)11-22-15-18-14(19-20-15)12-6-9-16-10-7-12/h6-7,9-10H,2-5,8,11H2,1H3,(H,17,21)(H,18,19,20)