1-[4-[(2S)-pyrrolidin-1-ium-2-yl]carbonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[4-[(2S)-pyrrolidin-1-ium-2-yl]carbonylpiperazin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[4-[(2S)-pyrrolidin-1-ium-2-carbonyl]piperazin-1-yl]-2-(2-thienyl)ethanone CAS Name: 1-[4-[oxo-[(2S)-2-pyrrolidin-1-iumyl]methyl]-1-piperazinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[4-[(2S)-pyrrolidin-1-ium-2-carbonyl]piperazin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[4-[(2S)-pyrrolidin-1-ium-2-carbonyl]piperazino]-2-(2-thienyl)ethanone Formula: C15H22N3O2S+ MolecularWeight: 308.41908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C(=O)N2CCN(CC2)C(=O)CC3=CC=CS3

Isomeric SMILES

C1C[C@H]([NH2+]C1)C(=O)N2CCN(CC2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C15H21N3O2S/c19-14(11-12-3-2-10-21-12)17-6-8-18(9-7-17)15(20)13-4-1-5-16-13/h2-3,10,13,16H,1,4-9,11H2/p+1/t13-/m0/s1