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

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC(=CC=C4)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=C(OC3=CC=CC=C32)C#N)C4=CC(=CC=C4)C

InChI

InChI=1S/C23H21N5O2S/c1-3-11-28-22(16-8-6-7-15(2)12-16)26-27-23(28)31-14-20(29)25-21-17-9-4-5-10-18(17)30-19(21)13-24/h4-10,12H,3,11,14H2,1-2H3,(H,25,29)