[4-(thiophen-2-ylcarbonylamino)phenyl] 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid [4-(2-thenoylamino)phenyl] ester Formula: C23H21FN2O5S2 MolecularWeight: 488.551643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4)F

InChI

InChI=1S/C23H21FN2O5S2/c24-19-11-6-16(15-21(19)33(29,30)26-12-2-1-3-13-26)23(28)31-18-9-7-17(8-10-18)25-22(27)20-5-4-14-32-20/h4-11,14-15H,1-3,12-13H2,(H,25,27)