3-[(2-chlorophenyl)methylsulfanyl]-2-phenyl-1H-1,2,4-triazol-2-ium

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-2-phenyl-1H-1,2,4-triazol-2-ium Openeye Name: 3-[(2-chlorophenyl)methylsulfanyl]-2-phenyl-1H-1,2,4-triazol-2-ium CAS Name: 3-[(2-chlorophenyl)methylthio]-2-phenyl-1H-1,2,4-triazol-2-ium IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-2-phenyl-1H-1,2,4-triazol-2-ium Traditional Name: 3-[(2-chlorobenzyl)thio]-2-phenyl-1H-1,2,4-triazol-2-ium Formula: C15H13ClN3S+ MolecularWeight: 302.80182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(N=CN2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C15H12ClN3S/c16-14-9-5-4-6-12(14)10-20-15-17-11-18-19(15)13-7-2-1-3-8-13/h1-9,11H,10H2/p+1