5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-2-fluoranyl-benzamide

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-2-fluoranyl-benzamide Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-2-fluoro-benzamide CAS Name: 5-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-N-(4-ethylphenyl)-2-fluorobenzamide IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-N-(4-ethylphenyl)-2-fluorobenzamide Traditional Name: 5-[4-(3-chlorophenyl)piperazino]sulfonyl-N-(4-ethylphenyl)-2-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=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)F

Isomeric SMILES

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

InChI

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