3-(2-ethoxy-5-octyl-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid

Systemtic Name: 3-(2-ethoxy-5-octyl-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Openeye Name: 3-(2-ethoxy-5-octyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid CAS Name: 3-(2-ethoxy-5-octylphenyl)-6-imidazo[2,1-b]thiazolecarboxylic acid IUPAC Name: 3-(2-ethoxy-5-octylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Traditional Name: 3-(2-ethoxy-5-octyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid Formula: C22H28N2O3S MolecularWeight: 400.53432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)OCC)C2=CSC3=NC(=CN23)C(=O)O

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)OCC)C2=CSC3=NC(=CN23)C(=O)O

InChI

InChI=1S/C22H28N2O3S/c1-3-5-6-7-8-9-10-16-11-12-20(27-4-2)17(13-16)19-15-28-22-23-18(21(25)26)14-24(19)22/h11-15H,3-10H2,1-2H3,(H,25,26)