2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide

Systemtic Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide Openeye Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentyl-propanamide CAS Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-cyclopentylpropanamide IUPAC Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopentylpropanamide Traditional Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-cyclopentyl-propionamide Formula: C16H19ClN4OS MolecularWeight: 350.86626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NNC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NNC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H19ClN4OS/c1-10(15(22)18-13-4-2-3-5-13)23-16-19-14(20-21-16)11-6-8-12(17)9-7-11/h6-10,13H,2-5H2,1H3,(H,18,22)(H,19,20,21)