1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxy-pyridin-3-yl]-3-(pyrazin-2-ylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxy-pyridin-3-yl]-3-(pyrazin-2-ylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-isopropoxy-3-pyridyl]-3-(pyrazin-2-ylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-6-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propan-2-yloxy-3-pyridinyl]-3-(2-pyrazinylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxypyridin-3-yl]-3-(pyrazin-2-ylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-6-[5-(4-ethylpiperazino)sulfonyl-2-isopropoxy-3-pyridyl]-3-(pyrazin-2-ylmethyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C26H33N9O4S MolecularWeight: 567.66312

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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)CC5=NC=CN=C5)OC(C)C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)C3=NC(=O)C4=C(NN(C4=N3)CC)CC5=NC=CN=C5)OC(C)C

InChI

InChI=1S/C26H33N9O4S/c1-5-33-9-11-34(12-10-33)40(37,38)19-14-20(26(29-16-19)39-17(3)4)23-30-24-22(25(36)31-23)21(32-35(24)6-2)13-18-15-27-7-8-28-18/h7-8,14-17,32H,5-6,9-13H2,1-4H3