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

Systemtic Name: N-(5-chloranyl-2-oxidanyl-phenyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-hydroxy-phenyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-hydroxyphenyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide IUPAC Name: N-(5-chloro-2-hydroxyphenyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-hydroxy-phenyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide Formula: C16H14ClN4O2S+ MolecularWeight: 361.82596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC(=O)NC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC(=O)NC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C16H13ClN4O2S/c17-11-6-7-14(22)13(8-11)20-15(23)9-24-16-18-10-19-21(16)12-4-2-1-3-5-12/h1-8,10H,9H2,(H2,20,22,23)/p+1