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

Systemtic Name: 2-[(4-butyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethyl-ethanamide Openeye Name: 2-[[4-butyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N,N-diethyl-acetamide CAS Name: 2-[(4-butyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N,N-diethylacetamide IUPAC Name: 2-[(4-butyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[[4-butyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N,N-diethyl-acetamide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SCC(=O)N(CC)CC)C2=CC=NC=C2

Isomeric SMILES

CCCCN1C(=NN=C1SCC(=O)N(CC)CC)C2=CC=NC=C2

InChI

InChI=1S/C17H25N5OS/c1-4-7-12-22-16(14-8-10-18-11-9-14)19-20-17(22)24-13-15(23)21(5-2)6-3/h8-11H,4-7,12-13H2,1-3H3