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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H25N5O3S/c1-18-3-9-21(10-4-18)32(30,31)26-17-19-5-7-20(8-6-19)22(29)27-13-15-28(16-14-27)23-24-11-2-12-25-23/h2-12,26H,13-17H2,1H3