3-fluoranyl-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzoic acid

Systemtic Name: 3-fluoranyl-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzoic acid Openeye Name: 3-fluoro-4-(4-thiazol-2-ylpiperazin-1-yl)benzoic acid CAS Name: 3-fluoro-4-[4-(2-thiazolyl)-1-piperazinyl]benzoic acid IUPAC Name: 3-fluoro-4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]benzoic acid Traditional Name: 3-fluoro-4-(4-thiazol-2-ylpiperazino)benzoic acid Formula: C14H14FN3O2S MolecularWeight: 307.343263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)O)F)C3=NC=CS3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)O)F)C3=NC=CS3

InChI

InChI=1S/C14H14FN3O2S/c15-11-9-10(13(19)20)1-2-12(11)17-4-6-18(7-5-17)14-16-3-8-21-14/h1-3,8-9H,4-7H2,(H,19,20)