5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one

Systemtic Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one Openeye Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridyl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one CAS Name: 5-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinyl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one IUPAC Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-3-yl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one Traditional Name: 5-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-3-pyridyl]-1,2-dimethyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-ium-7-one Formula: C23H34N7O4S+ MolecularWeight: 504.62556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=[N+](N1C)C)C(=O)N=C(N2)C3=CC(=CN=C3OCC)S(=O)(=O)N4CCN(CC4)CC

Isomeric SMILES

CCCC1=C2C(=[N+](N1C)C)C(=O)N=C(N2)C3=CC(=CN=C3OCC)S(=O)(=O)N4CCN(CC4)CC

InChI

InChI=1S/C23H33N7O4S/c1-6-9-18-19-20(28(5)27(18)4)22(31)26-21(25-19)17-14-16(15-24-23(17)34-8-3)35(32,33)30-12-10-29(7-2)11-13-30/h14-15H,6-13H2,1-5H3/p+1