2-[3-azanyl-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[3-azanyl-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[3-amino-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-N,N-diethyl-acetamide CAS Name: 2-[3-amino-5-[(2-chlorophenyl)methylthio]-1,2,4-triazol-4-yl]-N,N-diethylacetamide IUPAC Name: 2-[3-amino-5-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-yl]-N,N-diethylacetamide Traditional Name: 2-[3-amino-5-[(2-chlorobenzyl)thio]-1,2,4-triazol-4-yl]-N,N-diethyl-acetamide Formula: C15H20ClN5OS MolecularWeight: 353.8702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C(=NN=C1SCC2=CC=CC=C2Cl)N

Isomeric SMILES

CCN(CC)C(=O)CN1C(=NN=C1SCC2=CC=CC=C2Cl)N

InChI

InChI=1S/C15H20ClN5OS/c1-3-20(4-2)13(22)9-21-14(17)18-19-15(21)23-10-11-7-5-6-8-12(11)16/h5-8H,3-4,9-10H2,1-2H3,(H2,17,18)