2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethanoyl-1-benzofuran-3-yl)ethanamide

Systemtic Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethanoyl-1-benzofuran-3-yl)ethanamide Openeye Name: N-(2-acetylbenzofuran-3-yl)-2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-acetyl-3-benzofuranyl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-acetyl-1-benzofuran-3-yl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-acetylbenzofuran-3-yl)-2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=NN=C(N3C4CC4)CC5=CC=CS5

Isomeric SMILES

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=NN=C(N3C4CC4)CC5=CC=CS5

InChI

InChI=1S/C22H20N4O3S2/c1-13(27)21-20(16-6-2-3-7-17(16)29-21)23-19(28)12-31-22-25-24-18(26(22)14-8-9-14)11-15-5-4-10-30-15/h2-7,10,14H,8-9,11-12H2,1H3,(H,23,28)