[2,6-bis(chloranyl)phenyl]methyl 4-(1H-benzimidazol-2-ylsulfanyl)butanoate

Systemtic Name: [2,6-bis(chloranyl)phenyl]methyl 4-(1H-benzimidazol-2-ylsulfanyl)butanoate Openeye Name: (2,6-dichlorophenyl)methyl 4-(1H-benzimidazol-2-ylsulfanyl)butanoate CAS Name: 4-(1H-benzimidazol-2-ylthio)butanoic acid (2,6-dichlorophenyl)methyl ester IUPAC Name: (2,6-dichlorophenyl)methyl 4-(1H-benzimidazol-2-ylsulfanyl)butanoate Traditional Name: 4-(1H-benzimidazol-2-ylthio)butyric acid (2,6-dichlorobenzyl) ester Formula: C18H16Cl2N2O2S MolecularWeight: 395.30284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)OCC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)OCC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O2S/c19-13-5-3-6-14(20)12(13)11-24-17(23)9-4-10-25-18-21-15-7-1-2-8-16(15)22-18/h1-3,5-8H,4,9-11H2,(H,21,22)