N-(3-chloranyl-4-cyano-phenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H12ClN5OS MolecularWeight: 321.78528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C13H12ClN5OS/c1-2-11-17-13(19-18-11)21-7-12(20)16-9-4-3-8(6-15)10(14)5-9/h3-5H,2,7H2,1H3,(H,16,20)(H,17,18,19)