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2-[(2-chlorophenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazol-3-ium

2-[(2-chlorophenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazol-3-ium

Systemtic Name:2-[(2-chlorophenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazol-3-ium
Openeye Name:2-[(2-chlorophenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazol-3-ium
CAS Name:2-[(2-chlorophenyl)methylthio]-6-ethoxy-1H-benzimidazol-3-ium
IUPAC Name:2-[(2-chlorophenyl)methylsulfanyl]-6-ethoxy-1H-benzimidazol-3-ium
Traditional Name:2-[(2-chlorobenzyl)thio]-6-ethoxy-1H-benzimidazol-3-ium
Formula: C16H16ClN2OS+
MolecularWeight: 319.82904
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=CC=CC=C3Cl


Isomeric SMILES

CCOC1=CC2=C(C=C1)[NH+]=C(N2)SCC3=CC=CC=C3Cl


InChI

InChI=1S/C16H15ClN2OS/c1-2-20-12-7-8-14-15(9-12)19-16(18-14)21-10-11-5-3-4-6-13(11)17/h3-9H,2,10H2,1H3,(H,18,19)/p+1


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