(2R)-2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-2-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-2-[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-2-[4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-[4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]propionamide Formula: C11H17BrN3O3S2+ MolecularWeight: 383.30498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

C[C@H](C(=O)N)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C11H16BrN3O3S2/c1-8(11(13)16)14-4-6-15(7-5-14)20(17,18)10-3-2-9(12)19-10/h2-3,8H,4-7H2,1H3,(H2,13,16)/p+1/t8-/m1/s1