2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-yl-ethanamide

Systemtic Name: 2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-yl-ethanamide Openeye Name: 2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-quinolyl)acetamide CAS Name: 2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(5-quinolinyl)acetamide IUPAC Name: 2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-quinolin-5-ylacetamide Traditional Name: 2-[[5-(2-chlorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(5-quinolyl)acetamide Formula: C20H16ClN5OS MolecularWeight: 409.89194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)NC2=CC=CC3=C2C=CC=N3)C4=CC=CC=C4Cl

Isomeric SMILES

CN1C(=NN=C1SCC(=O)NC2=CC=CC3=C2C=CC=N3)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H16ClN5OS/c1-26-19(13-6-2-3-8-15(13)21)24-25-20(26)28-12-18(27)23-17-10-4-9-16-14(17)7-5-11-22-16/h2-11H,12H2,1H3,(H,23,27)