4-(4-chlorophenyl)-4-oxidanylidene-3-(1H-thieno[3,4-d]imidazol-2-ylsulfanyl)butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-4-oxidanylidene-3-(1H-thieno[3,4-d]imidazol-2-ylsulfanyl)butanoic acid Openeye Name: 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[3,4-d]imidazol-2-ylsulfanyl)butanoic acid CAS Name: 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[3,4-d]imidazol-2-ylthio)butanoic acid IUPAC Name: 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[3,4-d]imidazol-2-ylsulfanyl)butanoic acid Traditional Name: 4-(4-chlorophenyl)-4-keto-3-(1H-thien[3,4-d]imidazol-2-ylthio)butyric acid Formula: C15H11ClN2O3S2 MolecularWeight: 366.84244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C(CC(=O)O)SC2=NC3=CSC=C3N2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)C(CC(=O)O)SC2=NC3=CSC=C3N2)Cl

InChI

InChI=1S/C15H11ClN2O3S2/c16-9-3-1-8(2-4-9)14(21)12(5-13(19)20)23-15-17-10-6-22-7-11(10)18-15/h1-4,6-7,12H,5H2,(H,17,18)(H,19,20)