(2R)-2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-2-[4-[(5-bromanylthiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(5-bromo-2-thienyl)methyl]piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-2-[4-[(5-bromo-2-thiophenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-2-[4-[(5-bromothiophen-2-yl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-2-[4-[(5-bromo-2-thienyl)methyl]piperazine-1,4-diium-1-yl]propionamide Formula: C12H20BrN3OS+2 MolecularWeight: 334.2757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH+]1CC[NH+](CC1)CC2=CC=C(S2)Br

Isomeric SMILES

C[C@H](C(=O)N)[NH+]1CC[NH+](CC1)CC2=CC=C(S2)Br

InChI

InChI=1S/C12H18BrN3OS/c1-9(12(14)17)16-6-4-15(5-7-16)8-10-2-3-11(13)18-10/h2-3,9H,4-8H2,1H3,(H2,14,17)/p+2/t9-/m1/s1