3-[5-fluoranyl-2-(4-methylpiperazin-1-yl)phenyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[5-fluoranyl-2-(4-methylpiperazin-1-yl)phenyl]thiophene-2-carboxylic acid Openeye Name: 3-[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]thiophene-2-carboxylic acid CAS Name: 3-[5-fluoro-2-(4-methyl-1-piperazinyl)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[5-fluoro-2-(4-methylpiperazin-1-yl)phenyl]thiophene-2-carboxylic acid Traditional Name: 3-[5-fluoro-2-(4-methylpiperazino)phenyl]-2-thenoic acid Formula: C16H17FN2O2S MolecularWeight: 320.381783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)F)C3=C(SC=C3)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)F)C3=C(SC=C3)C(=O)O

InChI

InChI=1S/C16H17FN2O2S/c1-18-5-7-19(8-6-18)14-3-2-11(17)10-13(14)12-4-9-22-15(12)16(20)21/h2-4,9-10H,5-8H2,1H3,(H,20,21)