5-[(2S)-1-(2-methylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: 5-[(2S)-1-(2-methylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-isobutylpyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: 5-[(2S)-1-(2-methylpropyl)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-(2-methylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-isobutylpyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C13H21N2OS+ MolecularWeight: 253.38364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCCC1C2=CC=C(S2)C(=O)N

Isomeric SMILES

CC(C)C[NH+]1CCC[C@H]1C2=CC=C(S2)C(=O)N

InChI

InChI=1S/C13H20N2OS/c1-9(2)8-15-7-3-4-10(15)11-5-6-12(17-11)13(14)16/h5-6,9-10H,3-4,7-8H2,1-2H3,(H2,14,16)/p+1/t10-/m0/s1