2,3,4,5,6-pentamethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzenesulfonamide Formula: C22H33N5O2S MolecularWeight: 431.59472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)C)C

InChI

InChI=1S/C22H33N5O2S/c1-16-17(2)19(4)21(20(5)18(16)3)30(28,29)25-10-7-11-26-12-14-27(15-13-26)22-23-8-6-9-24-22/h6,8-9,25H,7,10-15H2,1-5H3