3-bromanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 3-bromanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 3-bromo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide CAS Name: 3-bromo-N-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 3-bromo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 3-bromo-N-[3-[4-(2-pyrimidyl)piperazino]sulfonylpropyl]benzamide Formula: C18H22BrN5O3S MolecularWeight: 468.36798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H22BrN5O3S/c19-16-5-1-4-15(14-16)17(25)20-8-3-13-28(26,27)24-11-9-23(10-12-24)18-21-6-2-7-22-18/h1-2,4-7,14H,3,8-13H2,(H,20,25)