N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-2-methyl-5-piperidinosulfonyl-benzamide Formula: C20H22BrFN2O3S MolecularWeight: 469.367683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=C(C=CC(=C3)Br)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O3S/c1-14-5-7-17(28(26,27)24-9-3-2-4-10-24)12-18(14)20(25)23-13-15-11-16(21)6-8-19(15)22/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,23,25)