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

Systemtic Name: 3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]carbonyl-N-cyclopropyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N-cyclopropyl-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N-cyclopropyl-4-methylbenzenesulfonamide IUPAC Name: 3-[4-(5-bromopyridin-2-yl)piperazine-1-carbonyl]-N-cyclopropyl-4-methylbenzenesulfonamide Traditional Name: 3-[4-(5-bromo-2-pyridyl)piperazine-1-carbonyl]-N-cyclopropyl-4-methyl-benzenesulfonamide Formula: C20H23BrN4O3S MolecularWeight: 479.39062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C20H23BrN4O3S/c1-14-2-6-17(29(27,28)23-16-4-5-16)12-18(14)20(26)25-10-8-24(9-11-25)19-7-3-15(21)13-22-19/h2-3,6-7,12-13,16,23H,4-5,8-11H2,1H3