2-[(2-tert-butylbenzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[(2-tert-butylbenzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[(2-tert-butylbenzimidazol-1-yl)methyl]thiazole-4-carboxylic acid CAS Name: 2-[(2-tert-butyl-1-benzimidazolyl)methyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[(2-tert-butylbenzimidazol-1-yl)methyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[(2-tert-butylbenzimidazol-1-yl)methyl]thiazole-4-carboxylic acid Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2N1CC3=NC(=CS3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2N1CC3=NC(=CS3)C(=O)O

InChI

InChI=1S/C16H17N3O2S/c1-16(2,3)15-18-10-6-4-5-7-12(10)19(15)8-13-17-11(9-22-13)14(20)21/h4-7,9H,8H2,1-3H3,(H,20,21)