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

Systemtic Name: 2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-1-benzofuran-3-yl)ethanamide Openeye Name: 2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyanobenzofuran-3-yl)acetamide CAS Name: 2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-cyano-3-benzofuranyl)acetamide IUPAC Name: 2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-cyano-1-benzofuran-3-yl)acetamide Traditional Name: 2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2-cyanobenzofuran-3-yl)acetamide Formula: C20H16N6O2S MolecularWeight: 404.44504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=C(OC4=CC=CC=C43)C#N

InChI

InChI=1S/C20H16N6O2S/c1-12-6-8-13(9-7-12)19-24-25-20(26(19)22)29-11-17(27)23-18-14-4-2-3-5-15(14)28-16(18)10-21/h2-9H,11,22H2,1H3,(H,23,27)