3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: 3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N-methoxy-N-methyl-benzenesulfonamide Openeye Name: 3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N-methoxy-N-methyl-benzenesulfonamide CAS Name: 3-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N-methoxy-N-methylbenzenesulfonamide IUPAC Name: 3-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]-N-methoxy-N-methylbenzenesulfonamide Traditional Name: 3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N-methoxy-N-methyl-benzenesulfonamide Formula: C18H21BrN4O4S MolecularWeight: 469.35274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrN4O4S/c1-21(27-2)28(25,26)16-5-3-4-14(12-16)18(24)23-10-8-22(9-11-23)17-7-6-15(19)13-20-17/h3-7,12-13H,8-11H2,1-2H3