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

Systemtic Name: N-(2-cyano-1-benzofuran-3-yl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanobenzofuran-3-yl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2-cyano-3-benzofuranyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-cyano-1-benzofuran-3-yl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-cyanobenzofuran-3-yl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H13N5O2S MolecularWeight: 375.40382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

InChI

InChI=1S/C19H13N5O2S/c20-10-16-18(14-8-4-5-9-15(14)26-16)22-17(25)11-27-19-21-12-24(23-19)13-6-2-1-3-7-13/h1-9,12H,11H2,(H,22,25)