4-[3-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]methyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]methyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[4-(2-thenyl)piperazine-1,4-diium-1-yl]methyl]phenyl]sulfonylmorpholine Formula: C20H29N3O3S2+2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)CC4=CC=CS4

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)CC4=CC=CS4

InChI

InChI=1S/C20H27N3O3S2/c24-28(25,23-10-12-26-13-11-23)20-5-1-3-18(15-20)16-21-6-8-22(9-7-21)17-19-4-2-14-27-19/h1-5,14-15H,6-13,16-17H2/p+2