ethyl 4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]butanoate

Systemtic Name: ethyl 4-[[6-(phenylcarbonyl)-1H-benzimidazol-2-yl]sulfanyl]butanoate Openeye Name: ethyl 4-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]butanoate CAS Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(6-benzoyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Traditional Name: 4-[(6-benzoyl-1H-benzimidazol-2-yl)thio]butyric acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-2-25-18(23)9-6-12-26-20-21-16-11-10-15(13-17(16)22-20)19(24)14-7-4-3-5-8-14/h3-5,7-8,10-11,13H,2,6,9,12H2,1H3,(H,21,22)