4-fluoranyl-3-[(4-methylpiperazin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid

Systemtic Name: 4-fluoranyl-3-[(4-methylpiperazin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Openeye Name: 4-fluoro-3-[(4-methylpiperazin-1-yl)methyl]benzothiophene-2-carboxylic acid CAS Name: 4-fluoro-3-[(4-methyl-1-piperazinyl)methyl]-1-benzothiophene-2-carboxylic acid IUPAC Name: 4-fluoro-3-[(4-methylpiperazin-1-yl)methyl]-1-benzothiophene-2-carboxylic acid Traditional Name: 4-fluoro-3-[(4-methylpiperazino)methyl]benzothiophene-2-carboxylic acid Formula: C15H17FN2O2S MolecularWeight: 308.371083

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

Isomeric SMILES

CN1CCN(CC1)CC2=C(SC3=CC=CC(=C32)F)C(=O)O

InChI

InChI=1S/C15H17FN2O2S/c1-17-5-7-18(8-6-17)9-10-13-11(16)3-2-4-12(13)21-14(10)15(19)20/h2-4H,5-9H2,1H3,(H,19,20)