N-cyclooctyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cyclooctyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cyclooctyl-2-[[4-isopentyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cyclooctyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cyclooctyl-2-[[4-(3-methylbutyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cyclooctyl-2-[[4-isoamyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C24H36N4O2S MolecularWeight: 444.63324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=NN=C1SCC(=O)NC2CCCCCCC2)COC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C(=NN=C1SCC(=O)NC2CCCCCCC2)COC3=CC=CC=C3

InChI

InChI=1S/C24H36N4O2S/c1-19(2)15-16-28-22(17-30-21-13-9-6-10-14-21)26-27-24(28)31-18-23(29)25-20-11-7-4-3-5-8-12-20/h6,9-10,13-14,19-20H,3-5,7-8,11-12,15-18H2,1-2H3,(H,25,29)