3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-pyrimidin-2-yl-benzamide

Systemtic Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-pyrimidin-2-yl-benzamide Openeye Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-pyrimidin-2-yl-benzamide CAS Name: 3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-N-(2-pyrimidinyl)benzamide IUPAC Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-pyrimidin-2-ylbenzamide Traditional Name: 3-[4-(4-fluorophenyl)piperazino]sulfonyl-N-(2-pyrimidyl)benzamide Formula: C21H20FN5O3S MolecularWeight: 441.478603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC(=C3)C(=O)NC4=NC=CC=N4

InChI

InChI=1S/C21H20FN5O3S/c22-17-5-7-18(8-6-17)26-11-13-27(14-12-26)31(29,30)19-4-1-3-16(15-19)20(28)25-21-23-9-2-10-24-21/h1-10,15H,11-14H2,(H,23,24,25,28)