2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-phenyl-imidazole-4-carboxylic acid

Systemtic Name: 2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-phenyl-imidazole-4-carboxylic acid Openeye Name: 2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]-3-phenyl-imidazole-4-carboxylic acid CAS Name: 2-[[2-(2,3-dimethoxyphenyl)-4-thiazolyl]methylthio]-3-phenyl-4-imidazolecarboxylic acid IUPAC Name: 2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-phenylimidazole-4-carboxylic acid Traditional Name: 2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylthio]-3-phenyl-imidazole-4-carboxylic acid Formula: C22H19N3O4S2 MolecularWeight: 453.53396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NC=C(N3C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NC=C(N3C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H19N3O4S2/c1-28-18-10-6-9-16(19(18)29-2)20-24-14(12-30-20)13-31-22-23-11-17(21(26)27)25(22)15-7-4-3-5-8-15/h3-12H,13H2,1-2H3,(H,26,27)