5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxy-pyridin-3-yl]-3-propyl-2-(pyridazin-3-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxy-pyridin-3-yl]-3-propyl-2-(pyridazin-3-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-isopropoxy-3-pyridyl]-3-propyl-2-(pyridazin-3-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-propan-2-yloxy-3-pyridinyl]-3-propyl-2-(3-pyridazinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-propan-2-yloxypyridin-3-yl]-3-propyl-2-(pyridazin-3-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[5-(4-ethylpiperazino)sulfonyl-2-isopropoxy-3-pyridyl]-3-propyl-2-(pyridazin-3-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C27H35N9O4S MolecularWeight: 581.6897

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC3=NN=CC=C3)C(=O)N=C(N2)C4=CC(=CN=C4OC(C)C)S(=O)(=O)N5CCN(CC5)CC

Isomeric SMILES

CCCC1=C2C(=NN1CC3=NN=CC=C3)C(=O)N=C(N2)C4=CC(=CN=C4OC(C)C)S(=O)(=O)N5CCN(CC5)CC

InChI

InChI=1S/C27H35N9O4S/c1-5-8-22-23-24(33-36(22)17-19-9-7-10-29-32-19)26(37)31-25(30-23)21-15-20(16-28-27(21)40-18(3)4)41(38,39)35-13-11-34(6-2)12-14-35/h7,9-10,15-16,18H,5-6,8,11-14,17H2,1-4H3,(H,30,31,37)