2-[[2-[(5-chloranyl-1-ethyl-benzimidazol-2-yl)sulfinylmethyl]-4-methoxy-3,5-dimethyl-phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[2-[(5-chloranyl-1-ethyl-benzimidazol-2-yl)sulfinylmethyl]-4-methoxy-3,5-dimethyl-phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[2-[(5-chloro-1-ethyl-benzimidazol-2-yl)sulfinylmethyl]-4-methoxy-3,5-dimethyl-phenyl]carbamoyl]benzoic acid CAS Name: 2-[[2-[(5-chloro-1-ethyl-2-benzimidazolyl)sulfinylmethyl]-4-methoxy-3,5-dimethylanilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[2-[(5-chloro-1-ethylbenzimidazol-2-yl)sulfinylmethyl]-4-methoxy-3,5-dimethylphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[2-[(5-chloro-1-ethyl-benzimidazol-2-yl)sulfinylmethyl]-4-methoxy-3,5-dimethyl-phenyl]carbamoyl]benzoic acid Formula: C27H26ClN3O5S MolecularWeight: 540.03044

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Cl)N=C1S(=O)CC3=C(C=C(C(=C3C)OC)C)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Cl)N=C1S(=O)CC3=C(C=C(C(=C3C)OC)C)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C27H26ClN3O5S/c1-5-31-23-11-10-17(28)13-22(23)30-27(31)37(35)14-20-16(3)24(36-4)15(2)12-21(20)29-25(32)18-8-6-7-9-19(18)26(33)34/h6-13H,5,14H2,1-4H3,(H,29,32)(H,33,34)