4-chloranyl-N,N-diethyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N,N-diethyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N,N-diethyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: 4-chloro-N,N-diethyl-3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N,N-diethyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: 4-chloro-N,N-diethyl-3-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C19H24ClN5O3S MolecularWeight: 437.94356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24ClN5O3S/c1-3-25(4-2)29(27,28)15-6-7-17(20)16(14-15)18(26)23-10-12-24(13-11-23)19-21-8-5-9-22-19/h5-9,14H,3-4,10-13H2,1-2H3