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

Systemtic Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-2-methyl-3-nitro-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridyl]-2-methyl-3-nitro-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinyl]-2-methyl-3-nitro-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-3-yl]-2-methyl-3-nitro-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-3-pyridyl]-2-methyl-3-nitro-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C19H24N8O6S MolecularWeight: 492.50886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C3=NC(=O)C4=NN(C(=C4N3)[N+](=O)[O-])C)OCC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C3=NC(=O)C4=NN(C(=C4N3)[N+](=O)[O-])C)OCC

InChI

InChI=1S/C19H24N8O6S/c1-4-25-6-8-26(9-7-25)34(31,32)12-10-13(18(20-11-12)33-5-2)16-21-15-14(17(28)22-16)23-24(3)19(15)27(29)30/h10-11H,4-9H2,1-3H3,(H,21,22,28)