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

Systemtic Name: N-(2,6-diethylphenyl)-2-fluoranyl-5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2,6-diethylphenyl)-2-fluoro-5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2,6-diethylphenyl)-2-fluoro-5-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2,6-diethylphenyl)-2-fluoro-5-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2,6-diethylphenyl)-2-fluoro-5-[4-(2-methoxyphenyl)piperazino]sulfonyl-benzamide Formula: C28H32FN3O4S MolecularWeight: 525.634783

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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=C4OC)F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OC)F

InChI

InChI=1S/C28H32FN3O4S/c1-4-20-9-8-10-21(5-2)27(20)30-28(33)23-19-22(13-14-24(23)29)37(34,35)32-17-15-31(16-18-32)25-11-6-7-12-26(25)36-3/h6-14,19H,4-5,15-18H2,1-3H3,(H,30,33)