5-[2-[2,4-bis(fluoranyl)phenyl]-1,3-thiazol-4-yl]-1-butyl-2-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 5-[2-[2,4-bis(fluoranyl)phenyl]-1,3-thiazol-4-yl]-1-butyl-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 1-butyl-5-[2-(2,4-difluorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid CAS Name: 1-butyl-5-[2-(2,4-difluorophenyl)-4-thiazolyl]-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 1-butyl-5-[2-(2,4-difluorophenyl)-1,3-thiazol-4-yl]-2-methylpyrrole-3-carboxylic acid Traditional Name: 1-butyl-5-[2-(2,4-difluorophenyl)thiazol-4-yl]-2-methyl-pyrrole-3-carboxylic acid Formula: C19H18F2N2O2S MolecularWeight: 376.420226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=C(C=C(C=C3)F)F)C(=O)O)C

Isomeric SMILES

CCCCN1C(=C(C=C1C2=CSC(=N2)C3=C(C=C(C=C3)F)F)C(=O)O)C

InChI

InChI=1S/C19H18F2N2O2S/c1-3-4-7-23-11(2)14(19(24)25)9-17(23)16-10-26-18(22-16)13-6-5-12(20)8-15(13)21/h5-6,8-10H,3-4,7H2,1-2H3,(H,24,25)