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

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[(4-chlorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-chlorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(4-chlorobenzyl)-N-methyl-acetamide Formula: C12H14ClN5OS MolecularWeight: 311.79046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Cl)C(=O)CSC2=NN=CN2N

Isomeric SMILES

CN(CC1=CC=C(C=C1)Cl)C(=O)CSC2=NN=CN2N

InChI

InChI=1S/C12H14ClN5OS/c1-17(6-9-2-4-10(13)5-3-9)11(19)7-20-12-16-15-8-18(12)14/h2-5,8H,6-7,14H2,1H3