2-[1-(4-chloranyl-3-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole

Systemtic Name: 2-[1-(4-chloranyl-3-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Openeye Name: 2-[1-(4-chloro-3-fluoro-phenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole CAS Name: 2-[1-(4-chloro-3-fluorophenyl)sulfonyl-4-piperidinyl]-1,3-benzothiazole IUPAC Name: 2-[1-(4-chloro-3-fluorophenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole Traditional Name: 2-[1-(4-chloro-3-fluoro-phenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole Formula: C18H16ClFN2O2S2 MolecularWeight: 410.913243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C18H16ClFN2O2S2/c19-14-6-5-13(11-15(14)20)26(23,24)22-9-7-12(8-10-22)18-21-16-3-1-2-4-17(16)25-18/h1-6,11-12H,7-10H2