4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyridin-2-yl]piperazine-1-sulfonic acid

Systemtic Name: 4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyridin-2-yl]piperazine-1-sulfonic acid Openeye Name: 4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-2-pyridyl]piperazine-1-sulfonic acid CAS Name: 4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-2-pyridinyl]-1-piperazinesulfonic acid IUPAC Name: 4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyridin-2-yl]piperazine-1-sulfonic acid Traditional Name: 4-[5-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-2-pyridyl]piperazine-1-sulfonic acid Formula: C18H18FN5O3S MolecularWeight: 403.430623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C3=NC=C(N3)C4=CC=C(C=C4)F)S(=O)(=O)O

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C3=NC=C(N3)C4=CC=C(C=C4)F)S(=O)(=O)O

InChI

InChI=1S/C18H18FN5O3S/c19-15-4-1-13(2-5-15)16-12-21-18(22-16)14-3-6-17(20-11-14)23-7-9-24(10-8-23)28(25,26)27/h1-6,11-12H,7-10H2,(H,21,22)(H,25,26,27)