1-methyl-4-[4-[(3S)-2-oxidanylideneoxolan-3-yl]piperazin-4-ium-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[(3S)-2-oxidanylideneoxolan-3-yl]piperazin-4-ium-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[(3S)-2-oxotetrahydrofuran-3-yl]piperazin-4-ium-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[(3S)-2-oxo-3-oxolanyl]-1-piperazin-4-iumyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[(3S)-2-oxooxolan-3-yl]piperazin-4-ium-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 4-[4-[(3S)-2-ketotetrahydrofuran-3-yl]piperazin-4-ium-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C14H21N4O5S+ MolecularWeight: 357.40534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CC[NH+](CC2)C3CCOC3=O

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CC[NH+](CC2)[C@H]3CCOC3=O

InChI

InChI=1S/C14H20N4O5S/c1-16-9-10(8-12(16)13(15)19)24(21,22)18-5-3-17(4-6-18)11-2-7-23-14(11)20/h8-9,11H,2-7H2,1H3,(H2,15,19)/p+1/t11-/m0/s1