N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]-3-piperidin-1-iumyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[(3R)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+]2CCCC(C2)CNC(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=NN1)C[NH+]2CCC[C@@H](C2)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C16H22N4OS/c1-12-8-14(19-18-12)11-20-6-2-4-13(10-20)9-17-16(21)15-5-3-7-22-15/h3,5,7-8,13H,2,4,6,9-11H2,1H3,(H,17,21)(H,18,19)/p+1/t13-/m1/s1