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

Systemtic Name: N-(5-chloranylpyridin-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-pyridyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-pyridinyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide IUPAC Name: N-(5-chloropyridin-2-yl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetamide Traditional Name: N-(5-chloro-2-pyridyl)-2-[(2-phenyl-1H-1,2,4-triazol-2-ium-3-yl)thio]acetamide Formula: C15H13ClN5OS+ MolecularWeight: 346.81462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN5OS/c16-11-6-7-13(17-8-11)20-14(22)9-23-15-18-10-19-21(15)12-4-2-1-3-5-12/h1-8,10H,9H2,(H,17,20,22)/p+1