2-[[5-(1-benzofuran-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-3-pyrrol-1-yl-phenyl)ethanamide

Systemtic Name: 2-[[5-(1-benzofuran-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-3-pyrrol-1-yl-phenyl)ethanamide Openeye Name: 2-[[5-(benzofuran-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-3-pyrrol-1-yl-phenyl)acetamide CAS Name: 2-[[5-(2-benzofuranyl)-1H-1,2,4-triazol-3-yl]thio]-N-[2-methyl-3-(1-pyrrolyl)phenyl]acetamide IUPAC Name: 2-[[5-(1-benzofuran-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-3-pyrrol-1-ylphenyl)acetamide Traditional Name: 2-[[5-(benzofuran-2-yl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-methyl-3-pyrrol-1-yl-phenyl)acetamide Formula: C23H19N5O2S MolecularWeight: 429.49426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC4=CC=CC=C4O3)N5C=CC=C5

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC4=CC=CC=C4O3)N5C=CC=C5

InChI

InChI=1S/C23H19N5O2S/c1-15-17(8-6-9-18(15)28-11-4-5-12-28)24-21(29)14-31-23-25-22(26-27-23)20-13-16-7-2-3-10-19(16)30-20/h2-13H,14H2,1H3,(H,24,29)(H,25,26,27)