4-[5,6-dimethyl-1-[(5-methyl-1-benzothiophen-3-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid

Systemtic Name: 4-[5,6-dimethyl-1-[(5-methyl-1-benzothiophen-3-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid Openeye Name: 4-[5,6-dimethyl-1-[(5-methylbenzothiophen-3-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid CAS Name: 4-[[5,6-dimethyl-1-[(5-methyl-1-benzothiophen-3-yl)methyl]-2-benzimidazolyl]thio]butanoic acid IUPAC Name: 4-[5,6-dimethyl-1-[(5-methyl-1-benzothiophen-3-yl)methyl]benzimidazol-2-yl]sulfanylbutanoic acid Traditional Name: 4-[[5,6-dimethyl-1-[(5-methylbenzothiophen-3-yl)methyl]benzimidazol-2-yl]thio]butyric acid Formula: C23H24N2O2S2 MolecularWeight: 424.57886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC=C2CN3C4=C(C=C(C(=C4)C)C)N=C3SCCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)SC=C2CN3C4=C(C=C(C(=C4)C)C)N=C3SCCCC(=O)O

InChI

InChI=1S/C23H24N2O2S2/c1-14-6-7-21-18(9-14)17(13-29-21)12-25-20-11-16(3)15(2)10-19(20)24-23(25)28-8-4-5-22(26)27/h6-7,9-11,13H,4-5,8,12H2,1-3H3,(H,26,27)