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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[(3-chlorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-chlorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(3-chlorobenzyl)-N-methyl-acetamide Formula: C12H14ClN5OS MolecularWeight: 311.79046

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)Cl)C(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CN(CC1=CC(=CC=C1)Cl)C(=O)CSC2=NNC(=N2)N

InChI

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