N-(2,6-diethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-(2,6-diethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoranyl-benzamide Openeye Name: N-(2,6-diethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluoro-benzamide CAS Name: N-(2,6-diethylphenyl)-5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-2-fluorobenzamide IUPAC Name: N-(2,6-diethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-2-fluorobenzamide Traditional Name: N-(2,6-diethylphenyl)-5-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-2-fluoro-benzamide Formula: C29H34FN3O3S MolecularWeight: 523.661963

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)F

InChI

InChI=1S/C29H34FN3O3S/c1-5-22-10-8-11-23(6-2)28(22)31-29(34)25-19-24(13-14-26(25)30)37(35,36)33-17-15-32(16-18-33)27-12-7-9-20(3)21(27)4/h7-14,19H,5-6,15-18H2,1-4H3,(H,31,34)