4-ethanoyl-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C17H23N4O2S+ MolecularWeight: 347.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC(=CN3)C(=O)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC(=CN3)C(=O)C

InChI

InChI=1S/C17H22N4O2S/c1-11-4-3-5-21(8-11)9-14-10-24-17(19-14)20-16(23)15-6-13(7-18-15)12(2)22/h6-7,10-11,18H,3-5,8-9H2,1-2H3,(H,19,20,23)/p+1/t11-/m0/s1