N-methyl-N-phenyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-phenyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-methyl-N-phenyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-methyl-3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-N-phenylbenzenesulfonamide IUPAC Name: N-methyl-N-phenyl-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-methyl-N-phenyl-3-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H23N5O3S/c1-25(19-8-3-2-4-9-19)31(29,30)20-10-5-7-18(17-20)21(28)26-13-15-27(16-14-26)22-23-11-6-12-24-22/h2-12,17H,13-16H2,1H3