2-chloranyl-6-fluoranyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 2-chloranyl-6-fluoranyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 2-chloro-6-fluoro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide CAS Name: 2-chloro-6-fluoro-N-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 2-chloro-6-fluoro-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 2-chloro-6-fluoro-N-[3-[4-(2-pyrimidyl)piperazino]sulfonylpropyl]benzamide Formula: C18H21ClFN5O3S MolecularWeight: 441.907443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H21ClFN5O3S/c19-14-4-1-5-15(20)16(14)17(26)21-8-3-13-29(27,28)25-11-9-24(10-12-25)18-22-6-2-7-23-18/h1-2,4-7H,3,8-13H2,(H,21,26)