2-bromanyl-N,N-dimethyl-5-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-bromanyl-N,N-dimethyl-5-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 2-bromo-N,N-dimethyl-5-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 2-bromo-N,N-dimethyl-5-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 2-bromo-N,N-dimethyl-5-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 2-bromo-N,N-dimethyl-5-[4-(4-pyridylmethyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C19H23BrN4O3S MolecularWeight: 467.37992

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)Br

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)Br

InChI

InChI=1S/C19H23BrN4O3S/c1-22(2)28(26,27)18-13-16(3-4-17(18)20)19(25)24-11-9-23(10-12-24)14-15-5-7-21-8-6-15/h3-8,13H,9-12,14H2,1-2H3