N-(4-bromanyl-2-fluoranyl-phenyl)-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-(4-methylpiperidino)sulfonyl-nipecotamide Formula: C18H25BrFN3O3S MolecularWeight: 462.376803

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H25BrFN3O3S/c1-13-6-9-22(10-7-13)27(25,26)23-8-2-3-14(12-23)18(24)21-17-5-4-15(19)11-16(17)20/h4-5,11,13-14H,2-3,6-10,12H2,1H3,(H,21,24)