N,N-diethyl-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-methoxy-benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-methoxy-benzenesulfonamide Openeye Name: N,N-diethyl-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-methoxy-benzenesulfonamide CAS Name: N,N-diethyl-3-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-4-methoxybenzenesulfonamide IUPAC Name: N,N-diethyl-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-4-methoxybenzenesulfonamide Traditional Name: N,N-diethyl-3-[4-(3-fluorophenyl)sulfonylpiperazino]-4-methoxy-benzenesulfonamide Formula: C21H28FN3O5S2 MolecularWeight: 485.592523

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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=CC=CC(=C3)F

Isomeric SMILES

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

InChI

InChI=1S/C21H28FN3O5S2/c1-4-24(5-2)31(26,27)19-9-10-21(30-3)20(16-19)23-11-13-25(14-12-23)32(28,29)18-8-6-7-17(22)15-18/h6-10,15-16H,4-5,11-14H2,1-3H3