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

Systemtic Name: 5-[(2S)-1-(2-methylpropyl)pyrrolidin-1-ium-2-yl]-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide Openeye Name: 5-[(2S)-1-isobutylpyrrolidin-1-ium-2-yl]-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide CAS Name: 5-[(2S)-1-(2-methylpropyl)-2-pyrrolidin-1-iumyl]-N-(1H-pyrazol-5-yl)-2-thiophenecarboxamide IUPAC Name: 5-[(2S)-1-(2-methylpropyl)pyrrolidin-1-ium-2-yl]-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide Traditional Name: 5-[(2S)-1-isobutylpyrrolidin-1-ium-2-yl]-N-(1H-pyrazol-5-yl)thiophene-2-carboxamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCCC1C2=CC=C(S2)C(=O)NC3=CC=NN3

Isomeric SMILES

CC(C)C[NH+]1CCC[C@H]1C2=CC=C(S2)C(=O)NC3=CC=NN3

InChI

InChI=1S/C16H22N4OS/c1-11(2)10-20-9-3-4-12(20)13-5-6-14(22-13)16(21)18-15-7-8-17-19-15/h5-8,11-12H,3-4,9-10H2,1-2H3,(H2,17,18,19,21)/p+1/t12-/m0/s1