N-(2-bromanyl-4-methyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C19H20BrFN2O3S MolecularWeight: 455.341103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F)Br

InChI

InChI=1S/C19H20BrFN2O3S/c1-13-4-9-18(17(20)11-13)22-19(24)14-3-2-10-23(12-14)27(25,26)16-7-5-15(21)6-8-16/h4-9,11,14H,2-3,10,12H2,1H3,(H,22,24)