N-prop-2-ynyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-prop-2-ynyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-prop-2-ynyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-prop-2-ynyl-2-[4-(1-pyrrolidinylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-prop-2-ynyl-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-propargyl-2-(4-pyrrolidinosulfonylpiperazin-1-ium-1-yl)acetamide Formula: C13H23N4O3S+ MolecularWeight: 315.41172

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C#CCNC(=O)C[NH+]1CCN(CC1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C13H22N4O3S/c1-2-5-14-13(18)12-15-8-10-17(11-9-15)21(19,20)16-6-3-4-7-16/h1H,3-12H2,(H,14,18)/p+1