6-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-3-yl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-3-pyridyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C26H31N7O4S MolecularWeight: 537.63384

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C3=NC(=O)C4=C(NN(C4=N3)CC)C5=CC=CC=C5)OCC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C3=NC(=O)C4=C(NN(C4=N3)CC)C5=CC=CC=C5)OCC

InChI

InChI=1S/C26H31N7O4S/c1-4-31-12-14-32(15-13-31)38(35,36)19-16-20(26(27-17-19)37-6-3)23-28-24-21(25(34)29-23)22(30-33(24)5-2)18-10-8-7-9-11-18/h7-11,16-17,30H,4-6,12-15H2,1-3H3