5,7-dimethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 5,7-dimethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 5,7-dimethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 5,7-dimethyl-N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinyl]-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 5,7-dimethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 5,7-dimethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)-3-piperidyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C20H31N6O+ MolecularWeight: 371.49974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC(=NN12)C(=O)NC3CCCN(C3)C4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=CC(=NC2=CC(=NN12)C(=O)N[C@H]3CCCN(C3)C4CC[NH+](CC4)C)C

InChI

InChI=1S/C20H30N6O/c1-14-11-15(2)26-19(21-14)12-18(23-26)20(27)22-16-5-4-8-25(13-16)17-6-9-24(3)10-7-17/h11-12,16-17H,4-10,13H2,1-3H3,(H,22,27)/p+1/t16-/m0/s1