6-bromanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 6-bromanyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 6-bromo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 6-bromo-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 6-bromo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 6-bromo-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C16H23BrN5O+ MolecularWeight: 381.29072

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NN3C=C(C=NC3=C2)Br)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=NN3C=C(C=NC3=C2)Br)C

InChI

InChI=1S/C16H22BrN5O/c1-15(2)6-11(7-16(3,4)21-15)19-14(23)12-5-13-18-8-10(17)9-22(13)20-12/h5,8-9,11,21H,6-7H2,1-4H3,(H,19,23)/p+1