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

Systemtic Name: N-(2-ethylphenyl)-4-fluoranyl-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2-ethylphenyl)-4-fluoro-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2-ethylphenyl)-4-fluoro-3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2-ethylphenyl)-4-fluoro-3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2-ethylphenyl)-4-fluoro-3-[4-(2-fluorophenyl)piperazino]sulfonyl-benzamide Formula: C25H25F2N3O3S MolecularWeight: 485.546106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4F

InChI

InChI=1S/C25H25F2N3O3S/c1-2-18-7-3-5-9-22(18)28-25(31)19-11-12-21(27)24(17-19)34(32,33)30-15-13-29(14-16-30)23-10-6-4-8-20(23)26/h3-12,17H,2,13-16H2,1H3,(H,28,31)