[2-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]phenyl]methanamine

Systemtic Name: [2-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]phenyl]methanamine Openeye Name: [2-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]phenyl]methanamine CAS Name: [2-[2-(1H-benzimidazol-2-ylthio)ethoxy]phenyl]methanamine IUPAC Name: [2-[2-(1H-benzimidazol-2-ylsulfanyl)ethoxy]phenyl]methanamine Traditional Name: [2-[2-(1H-benzimidazol-2-ylthio)ethoxy]benzyl]amine Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN)OCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1=CC=C(C(=C1)CN)OCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H17N3OS/c17-11-12-5-1-4-8-15(12)20-9-10-21-16-18-13-6-2-3-7-14(13)19-16/h1-8H,9-11,17H2,(H,18,19)