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

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H17N5O3S MolecularWeight: 419.45638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H17N5O3S/c1-26-20(13-7-9-14(28-2)10-8-13)24-25-21(26)30-12-18(27)23-19-15-5-3-4-6-16(15)29-17(19)11-22/h3-10H,12H2,1-2H3,(H,23,27)