2-(phenylmethylsulfanyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium

Systemtic Name: 2-(phenylmethylsulfanyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium Openeye Name: 2-benzylsulfanyl-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium CAS Name: 2-(phenylmethylthio)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium IUPAC Name: 2-benzylsulfanyl-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium Traditional Name: 2-(benzylthio)-1,5,6,7-tetrahydropyrrol[1,2-a]imidazol-4-ium Formula: C13H15N2S+ MolecularWeight: 231.3366

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=[N+](C1)C=C(N2)SCC3=CC=CC=C3

Isomeric SMILES

C1CC2=[N+](C1)C=C(N2)SCC3=CC=CC=C3

InChI

InChI=1S/C13H14N2S/c1-2-5-11(6-3-1)10-16-13-9-15-8-4-7-12(15)14-13/h1-3,5-6,9H,4,7-8,10H2/p+1