N-(2-cyano-1-benzofuran-3-yl)-2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[4-ethyl-5-(m-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC(=CC=C4)C

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC(=CC=C4)C

InChI

InChI=1S/C22H19N5O2S/c1-3-27-21(15-8-6-7-14(2)11-15)25-26-22(27)30-13-19(28)24-20-16-9-4-5-10-17(16)29-18(20)12-23/h4-11H,3,13H2,1-2H3,(H,24,28)