5-[5-(4-ethyl-4-oxidanidyl-piperazin-4-ium-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridin-3-yl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[5-(4-ethyl-4-oxidanidyl-piperazin-4-ium-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridin-3-yl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[5-(4-ethyl-4-oxido-piperazin-4-ium-1-yl)sulfonyl-2-(2-methoxyethoxy)-3-pyridyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[5-[(4-ethyl-4-oxido-1-piperazin-4-iumyl)sulfonyl]-2-(2-methoxyethoxy)-3-pyridinyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[5-(4-ethyl-4-oxidopiperazin-4-ium-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridin-3-yl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[5-(4-ethyl-4-oxido-piperazin-4-ium-1-yl)sulfonyl-2-(2-methoxyethoxy)-3-pyridyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H33N7O6S MolecularWeight: 535.61642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC(=CN=C3OCCOC)S(=O)(=O)N4CC[N+](CC4)(CC)[O-])C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC(=CN=C3OCCOC)S(=O)(=O)N4CC[N+](CC4)(CC)[O-])C

InChI

InChI=1S/C23H33N7O6S/c1-5-7-18-19-20(28(3)27-18)22(31)26-21(25-19)17-14-16(15-24-23(17)36-13-12-35-4)37(33,34)29-8-10-30(32,6-2)11-9-29/h14-15H,5-13H2,1-4H3,(H,25,26,31)