5-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-ylidene]-methylsulfonyl-methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-ylidene]-methylsulfonyl-methyl]thiophene-2-carboxylic acid Openeye Name: 5-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-ylidene]-methylsulfonyl-methyl]thiophene-2-carboxylic acid CAS Name: 5-[[1-[bis(4-chlorophenyl)methyl]-3-azetidinylidene]-methylsulfonylmethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-ylidene]-methylsulfonylmethyl]thiophene-2-carboxylic acid Traditional Name: 5-[[1-[bis(4-chlorophenyl)methyl]azetidin-3-ylidene]-mesyl-methyl]-2-thenoic acid Formula: C23H19Cl2NO4S2 MolecularWeight: 508.43726

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(=C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(S4)C(=O)O

Isomeric SMILES

CS(=O)(=O)C(=C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=C(S4)C(=O)O

InChI

InChI=1S/C23H19Cl2NO4S2/c1-32(29,30)22(19-10-11-20(31-19)23(27)28)16-12-26(13-16)21(14-2-6-17(24)7-3-14)15-4-8-18(25)9-5-15/h2-11,21H,12-13H2,1H3,(H,27,28)