4-fluoranyl-3-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-(4-phenoxyphenyl)benzamide

Systemtic Name: 4-fluoranyl-3-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-(4-phenoxyphenyl)benzamide Openeye Name: 4-fluoro-3-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-(4-phenoxyphenyl)benzamide CAS Name: 4-fluoro-3-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]-N-(4-phenoxyphenyl)benzamide IUPAC Name: 4-fluoro-3-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-(4-phenoxyphenyl)benzamide Traditional Name: 4-fluoro-3-[4-(2-methoxyphenyl)piperazino]sulfonyl-N-(4-phenoxyphenyl)benzamide Formula: C30H28FN3O5S MolecularWeight: 561.623823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)F

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)F

InChI

InChI=1S/C30H28FN3O5S/c1-38-28-10-6-5-9-27(28)33-17-19-34(20-18-33)40(36,37)29-21-22(11-16-26(29)31)30(35)32-23-12-14-25(15-13-23)39-24-7-3-2-4-8-24/h2-16,21H,17-20H2,1H3,(H,32,35)