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

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(2-chlorobenzyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H15ClN4OS2 MolecularWeight: 378.8995

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1Cl)SC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1Cl)SC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C16H15ClN4OS2/c1-10(15(22)18-9-11-5-2-3-6-12(11)17)24-16-19-14(20-21-16)13-7-4-8-23-13/h2-8,10H,9H2,1H3,(H,18,22)(H,19,20,21)