1-(cyclohexylmethyl)-5-[2-(2-ethylpyridin-4-yl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-(cyclohexylmethyl)-5-[2-(2-ethylpyridin-4-yl)-1,3-thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 1-(cyclohexylmethyl)-5-[2-(2-ethyl-4-pyridyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid CAS Name: 1-(cyclohexylmethyl)-5-[2-(2-ethyl-4-pyridinyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 1-(cyclohexylmethyl)-5-[2-(2-ethylpyridin-4-yl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxylic acid Traditional Name: 1-(cyclohexylmethyl)-5-[2-(2-ethyl-4-pyridyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Formula: C23H27N3O2S MolecularWeight: 409.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CC(=C1)C2=NC(=CS2)C3=CC(=C(N3CC4CCCCC4)C)C(=O)O

Isomeric SMILES

CCC1=NC=CC(=C1)C2=NC(=CS2)C3=CC(=C(N3CC4CCCCC4)C)C(=O)O

InChI

InChI=1S/C23H27N3O2S/c1-3-18-11-17(9-10-24-18)22-25-20(14-29-22)21-12-19(23(27)28)15(2)26(21)13-16-7-5-4-6-8-16/h9-12,14,16H,3-8,13H2,1-2H3,(H,27,28)