2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[[5-(3-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)acetamide Formula: C22H19N5O2S MolecularWeight: 417.48356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H19N5O2S/c1-14(28)23-17-9-4-8-16(12-17)21-25-22(27-26-21)30-13-20(29)24-19-11-5-7-15-6-2-3-10-18(15)19/h2-12H,13H2,1H3,(H,23,28)(H,24,29)(H,25,26,27)