2-[4-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(4,5-dibromo-2-thiophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(4,5-dibromothiophene-2-carbonyl)piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C13H18Br2N3O2S+ MolecularWeight: 440.17392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17Br2N3O2S/c1-16(2)11(19)8-17-3-5-18(6-4-17)13(20)10-7-9(14)12(15)21-10/h7H,3-6,8H2,1-2H3/p+1