3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide Formula: C19H24BrN5O3S MolecularWeight: 482.39456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

InChI

InChI=1S/C19H24BrN5O3S/c1-3-25(4-2)29(27,28)17-7-5-6-15(12-17)18(26)23-8-10-24(11-9-23)19-21-13-16(20)14-22-19/h5-7,12-14H,3-4,8-11H2,1-2H3