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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H16ClN5OS MolecularWeight: 373.85984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)Cl

InChI

InChI=1S/C17H16ClN5OS/c18-14-3-1-12(2-4-14)5-10-20-15(24)11-25-17-21-16(22-23-17)13-6-8-19-9-7-13/h1-4,6-9H,5,10-11H2,(H,20,24)(H,21,22,23)