3-(4,5-dimethyl-2-phenylmethoxy-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid

Systemtic Name: 3-(4,5-dimethyl-2-phenylmethoxy-phenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Openeye Name: 3-(2-benzyloxy-4,5-dimethyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid CAS Name: 3-(4,5-dimethyl-2-phenylmethoxyphenyl)-6-imidazo[2,1-b]thiazolecarboxylic acid IUPAC Name: 3-(4,5-dimethyl-2-phenylmethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid Traditional Name: 3-(2-benzoxy-4,5-dimethyl-phenyl)imidazo[2,1-b]thiazole-6-carboxylic acid Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2=CSC3=NC(=CN23)C(=O)O)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C(=C1)C2=CSC3=NC(=CN23)C(=O)O)OCC4=CC=CC=C4)C

InChI

InChI=1S/C21H18N2O3S/c1-13-8-16(18-12-27-21-22-17(20(24)25)10-23(18)21)19(9-14(13)2)26-11-15-6-4-3-5-7-15/h3-10,12H,11H2,1-2H3,(H,24,25)