(2R)-1-morpholin-4-yl-2-phenyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: (2R)-1-morpholin-4-yl-2-phenyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanone Openeye Name: (2R)-1-morpholino-2-phenyl-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]ethanone CAS Name: (2R)-1-(4-morpholinyl)-2-phenyl-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)ethanone IUPAC Name: (2R)-1-morpholin-4-yl-2-phenyl-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanone Traditional Name: (2R)-1-morpholino-2-phenyl-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]ethanone Formula: C20H26N3O4S2+ MolecularWeight: 436.56814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H25N3O4S2/c24-20(22-12-14-27-15-13-22)19(17-5-2-1-3-6-17)21-8-10-23(11-9-21)29(25,26)18-7-4-16-28-18/h1-7,16,19H,8-15H2/p+1/t19-/m1/s1