4-fluoranyl-2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-2-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)carbonylphenyl]benzenesulfonamide Openeye Name: 4-fluoro-2-methyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 4-fluoro-2-methyl-N-[2-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-2-methyl-N-[2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 4-fluoro-2-methyl-N-[2-[4-(2-pyrimidyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide Formula: C22H22FN5O3S MolecularWeight: 455.505183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H22FN5O3S/c1-16-15-17(23)7-8-20(16)32(30,31)26-19-6-3-2-5-18(19)21(29)27-11-13-28(14-12-27)22-24-9-4-10-25-22/h2-10,15,26H,11-14H2,1H3