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

Systemtic Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-4-fluoranyl-benzamide Openeye Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-4-fluoro-benzamide CAS Name: 3-[[4-(2-chlorophenyl)-1-piperazinyl]sulfonyl]-N-(4-ethylphenyl)-4-fluorobenzamide IUPAC Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-4-fluorobenzamide Traditional Name: 3-[4-(2-chlorophenyl)piperazino]sulfonyl-N-(4-ethylphenyl)-4-fluoro-benzamide Formula: C25H25ClFN3O3S MolecularWeight: 502.000703

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H25ClFN3O3S/c1-2-18-7-10-20(11-8-18)28-25(31)19-9-12-22(27)24(17-19)34(32,33)30-15-13-29(14-16-30)23-6-4-3-5-21(23)26/h3-12,17H,2,13-16H2,1H3,(H,28,31)