2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-pentyl-ethanamide

Systemtic Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-pentyl-ethanamide Openeye Name: 2-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-pentyl-acetamide CAS Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-pentylacetamide IUPAC Name: 2-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-pentylacetamide Traditional Name: N-amyl-2-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCCNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C17H24N4O2S/c1-3-5-6-11-18-15(22)12-21-16(19-20-17(21)24)13-7-9-14(10-8-13)23-4-2/h7-10H,3-6,11-12H2,1-2H3,(H,18,22)(H,20,24)