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4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]benzoate

4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]benzoate

Systemtic Name:4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]benzoate
Openeye Name:4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]benzoate
CAS Name:4-[3-(1H-benzimidazol-2-ylthio)propoxy]benzoate
IUPAC Name:4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]benzoate
Traditional Name:4-[3-(1H-benzimidazol-2-ylthio)propoxy]benzoate
Formula: C17H15N2O3S-
MolecularWeight: 327.3776
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCOC3=CC=C(C=C3)C(=O)[O-]


Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCOC3=CC=C(C=C3)C(=O)[O-]


InChI

InChI=1S/C17H16N2O3S/c20-16(21)12-6-8-13(9-7-12)22-10-3-11-23-17-18-14-4-1-2-5-15(14)19-17/h1-2,4-9H,3,10-11H2,(H,18,19)(H,20,21)/p-1


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