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

Systemtic Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-nonyl-ethanamide Openeye Name: N-nonyl-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-nonylacetamide IUPAC Name: 2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-nonylacetamide Traditional Name: N-nonyl-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C20H30N4OS MolecularWeight: 374.5434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCNC(=O)CN1C(=NNC1=S)C2=CC=C(C=C2)C

InChI

InChI=1S/C20H30N4OS/c1-3-4-5-6-7-8-9-14-21-18(25)15-24-19(22-23-20(24)26)17-12-10-16(2)11-13-17/h10-13H,3-9,14-15H2,1-2H3,(H,21,25)(H,23,26)