4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]morpholin-4-ium

Systemtic Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]morpholin-4-ium Openeye Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]morpholin-4-ium CAS Name: 4-[2-(1H-benzimidazol-2-ylthio)ethyl]morpholin-4-ium IUPAC Name: 4-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]morpholin-4-ium Traditional Name: 4-[2-(1H-benzimidazol-2-ylthio)ethyl]morpholin-4-ium Formula: C13H18N3OS+ MolecularWeight: 264.36652

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C13H17N3OS/c1-2-4-12-11(3-1)14-13(15-12)18-10-7-16-5-8-17-9-6-16/h1-4H,5-10H2,(H,14,15)/p+1