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

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-chlorophenyl)ethyl]ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(4-chlorophenyl)ethyl]acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[2-(4-chlorophenyl)ethyl]acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-chlorophenyl)ethyl]acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[2-(4-chlorophenyl)ethyl]acetamide Formula: C17H17ClN6OS MolecularWeight: 388.87448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN6OS/c18-14-5-3-12(4-6-14)7-9-21-15(25)11-26-17-23-22-16(24(17)19)13-2-1-8-20-10-13/h1-6,8,10H,7,9,11,19H2,(H,21,25)