3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N,N-diethyl-4-methoxy-benzenesulfonamide

Systemtic Name: 3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-N,N-diethyl-4-methoxy-benzenesulfonamide Openeye Name: 3-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-N,N-diethyl-4-methoxy-benzenesulfonamide CAS Name: 3-[4-(2,6-difluorophenyl)sulfonyl-1-piperazinyl]-N,N-diethyl-4-methoxybenzenesulfonamide IUPAC Name: 3-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-yl]-N,N-diethyl-4-methoxybenzenesulfonamide Traditional Name: 3-[4-(2,6-difluorophenyl)sulfonylpiperazino]-N,N-diethyl-4-methoxy-benzenesulfonamide Formula: C21H27F2N3O5S2 MolecularWeight: 503.582986

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3F)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C21H27F2N3O5S2/c1-4-25(5-2)32(27,28)16-9-10-20(31-3)19(15-16)24-11-13-26(14-12-24)33(29,30)21-17(22)7-6-8-18(21)23/h6-10,15H,4-5,11-14H2,1-3H3