N-(4-ethylphenyl)-2-fluoranyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-ethylphenyl)-2-fluoranyl-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-2-fluoro-5-[4-(2-pyridyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(4-ethylphenyl)-2-fluoro-5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-2-fluoro-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-2-fluoro-5-[4-(2-pyridyl)piperazino]sulfonyl-benzamide Formula: C24H25FN4O3S MolecularWeight: 468.543703

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)F

InChI

InChI=1S/C24H25FN4O3S/c1-2-18-6-8-19(9-7-18)27-24(30)21-17-20(10-11-22(21)25)33(31,32)29-15-13-28(14-16-29)23-5-3-4-12-26-23/h3-12,17H,2,13-16H2,1H3,(H,27,30)