2-(azetidin-3-yl)-3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-pentan-2-yloxy-pyridin-3-yl]-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 2-(azetidin-3-yl)-3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-pentan-2-yloxy-pyridin-3-yl]-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 2-(azetidin-3-yl)-3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(1-methylbutoxy)-3-pyridyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 2-(3-azetidinyl)-3-ethyl-5-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-pentan-2-yloxy-3-pyridinyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 2-(azetidin-3-yl)-3-ethyl-5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-pentan-2-yloxypyridin-3-yl]-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 2-(azetidin-3-yl)-3-ethyl-5-[5-(4-ethylpiperazino)sulfonyl-2-(1-methylbutoxy)-3-pyridyl]-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C26H38N8O4S MolecularWeight: 558.69612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)C4CNC4)S(=O)(=O)N5CCN(CC5)CC

Isomeric SMILES

CCCC(C)OC1=NC=C(C=C1C2=NC(=O)C3=NN(C(=C3N2)CC)C4CNC4)S(=O)(=O)N5CCN(CC5)CC

InChI

InChI=1S/C26H38N8O4S/c1-5-8-17(4)38-26-20(13-19(16-28-26)39(36,37)33-11-9-32(7-3)10-12-33)24-29-22-21(6-2)34(18-14-27-15-18)31-23(22)25(35)30-24/h13,16-18,27H,5-12,14-15H2,1-4H3,(H,29,30,35)