4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide Formula: C20H25BrN4O3S MolecularWeight: 481.4065

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C20H25BrN4O3S/c1-3-25(4-2)29(27,28)18-8-5-16(6-9-18)20(26)24-13-11-23(12-14-24)19-10-7-17(21)15-22-19/h5-10,15H,3-4,11-14H2,1-2H3