3-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-1-phenyl-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thieno[2,3-c]pyrazole-5-carboxamide Formula: C22H29N4OS+ MolecularWeight: 397.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3CC([NH2+]C(C3)(C)C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3CC([NH2+]C(C3)(C)C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4OS/c1-14-17-11-18(28-20(17)26(24-14)16-9-7-6-8-10-16)19(27)23-15-12-21(2,3)25-22(4,5)13-15/h6-11,15,25H,12-13H2,1-5H3,(H,23,27)/p+1