N-(4-bromanyl-2-fluoranyl-phenyl)-1-morpholin-4-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-morpholin-4-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-morpholinosulfonyl-piperidine-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-(4-morpholinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-morpholin-4-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-morpholinosulfonyl-nipecotamide Formula: C16H21BrFN3O4S MolecularWeight: 450.323043

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H21BrFN3O4S/c17-13-3-4-15(14(18)10-13)19-16(22)12-2-1-5-21(11-12)26(23,24)20-6-8-25-9-7-20/h3-4,10,12H,1-2,5-9,11H2,(H,19,22)