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

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[(4-chlorophenyl)methyl]acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(4-chlorobenzyl)acetamide Formula: C11H12ClN5OS MolecularWeight: 297.76388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CSC2=NN=CN2N)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CSC2=NN=CN2N)Cl

InChI

InChI=1S/C11H12ClN5OS/c12-9-3-1-8(2-4-9)5-14-10(18)6-19-11-16-15-7-17(11)13/h1-4,7H,5-6,13H2,(H,14,18)