3,3-dimethyl-2-[3-(4-methylsulfinyl-1,3-thiazol-2-yl)-2-oxidanylidene-benzimidazol-1-yl]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[3-(4-methylsulfinyl-1,3-thiazol-2-yl)-2-oxidanylidene-benzimidazol-1-yl]butanoic acid Openeye Name: 3,3-dimethyl-2-[3-(4-methylsulfinylthiazol-2-yl)-2-oxo-benzimidazol-1-yl]butanoic acid CAS Name: 3,3-dimethyl-2-[3-(4-methylsulfinyl-2-thiazolyl)-2-oxo-1-benzimidazolyl]butanoic acid IUPAC Name: 3,3-dimethyl-2-[3-(4-methylsulfinyl-1,3-thiazol-2-yl)-2-oxobenzimidazol-1-yl]butanoic acid Traditional Name: 2-[2-keto-3-(4-methylsulfinylthiazol-2-yl)benzimidazol-1-yl]-3,3-dimethyl-butyric acid Formula: C17H19N3O4S2 MolecularWeight: 393.48046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)N1C2=CC=CC=C2N(C1=O)C3=NC(=CS3)S(=O)C

Isomeric SMILES

CC(C)(C)C(C(=O)O)N1C2=CC=CC=C2N(C1=O)C3=NC(=CS3)S(=O)C

InChI

InChI=1S/C17H19N3O4S2/c1-17(2,3)13(14(21)22)19-10-7-5-6-8-11(10)20(16(19)23)15-18-12(9-25-15)26(4)24/h5-9,13H,1-4H3,(H,21,22)