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

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC(=O)NC3=C(OC4=CC=CC=C43)C#N)C

InChI

InChI=1S/C21H17N5O2S/c1-13-7-3-5-9-16(13)26-14(2)24-25-21(26)29-12-19(27)23-20-15-8-4-6-10-17(15)28-18(20)11-22/h3-10H,12H2,1-2H3,(H,23,27)