[(2R)-2-(4-bromanylthiophen-2-yl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(4-bromanylthiophen-2-yl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2R)-2-(4-bromo-2-thienyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2R)-2-(4-bromo-2-thiophenyl)-2-(4-propyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2R)-2-(4-bromothiophen-2-yl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2R)-2-(4-bromo-2-thienyl)-2-(4-propylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C13H24BrN3S+2 MolecularWeight: 334.31876

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(C[NH3+])C2=CC(=CS2)Br

Isomeric SMILES

CCC[NH+]1CCN(CC1)[C@H](C[NH3+])C2=CC(=CS2)Br

InChI

InChI=1S/C13H22BrN3S/c1-2-3-16-4-6-17(7-5-16)12(9-15)13-8-11(14)10-18-13/h8,10,12H,2-7,9,15H2,1H3/p+2/t12-/m1/s1