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4-{3-[(4-methyl-1-benzothiophen-3-yl)methyl]-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl}butanoic acid


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Chemical Component Summary

Name4-{3-[(4-methyl-1-benzothiophen-3-yl)methyl]-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl}butanoic acid
Identifiers4-[3-[(4-methyl-1-benzothiophen-3-yl)methyl]-2-oxidanylidene-benzimidazol-1-yl]butanoic acid
FormulaC21 H20 N2 O3 S
Molecular Weight380.46
TypeNON-POLYMER
Isomeric SMILESCc1cccc2c1c(cs2)CN3c4ccccc4N(C3=O)CCCC(=O)O
InChIInChI=1S/C21H20N2O3S/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22(21(23)26)11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25)
InChIKeyWYBNXPWKJQJMLG-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count50
Aromatic Bond Count16

Related Resource References

Resource NameReference
Pharos CHEMBL1807643
PubChem 53249965
ChEMBL CHEMBL1807643