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

Systemtic Name: N-ethyl-N-phenyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-ethyl-N-phenyl-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide CAS Name: N-ethyl-4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-N-phenylbenzenesulfonamide IUPAC Name: N-ethyl-N-phenyl-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)benzenesulfonamide Traditional Name: N-ethyl-N-phenyl-4-[4-(2-pyrimidyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N5O3S/c1-2-28(20-7-4-3-5-8-20)32(30,31)21-11-9-19(10-12-21)22(29)26-15-17-27(18-16-26)23-24-13-6-14-25-23/h3-14H,2,15-18H2,1H3