3-(5-tert-butyl-2-phenylmethoxy-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid

Systemtic Name: 3-(5-tert-butyl-2-phenylmethoxy-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Openeye Name: 3-(2-benzyloxy-5-tert-butyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid CAS Name: 3-(5-tert-butyl-2-phenylmethoxyphenyl)-6-imidazo[2,1-b]thiazolecarboxylic acid IUPAC Name: 3-(5-tert-butyl-2-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Traditional Name: 3-(2-benzoxy-5-tert-butyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC4=NC(=CN34)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC4=NC(=CN34)C(=O)O

InChI

InChI=1S/C23H22N2O3S/c1-23(2,3)16-9-10-20(28-13-15-7-5-4-6-8-15)17(11-16)19-14-29-22-24-18(21(26)27)12-25(19)22/h4-12,14H,13H2,1-3H3,(H,26,27)