N-(2-ethanoyl-1-benzofuran-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-ethanoyl-1-benzofuran-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-acetylbenzofuran-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-acetyl-3-benzofuranyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-acetyl-1-benzofuran-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-acetylbenzofuran-3-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H16N4O3S/c1-13(25)19-18(15-9-5-6-10-16(15)27-19)22-17(26)11-28-20-23-21-12-24(20)14-7-3-2-4-8-14/h2-10,12H,11H2,1H3,(H,22,26)