3-ethyl-5-[5-(4-methoxypiperidin-1-yl)sulfonyl-2-propoxy-phenyl]-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-ethyl-5-[5-(4-methoxypiperidin-1-yl)sulfonyl-2-propoxy-phenyl]-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-ethyl-5-[5-[(4-methoxy-1-piperidyl)sulfonyl]-2-propoxy-phenyl]-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-ethyl-5-[5-[(4-methoxy-1-piperidinyl)sulfonyl]-2-propoxyphenyl]-2-(2-pyridinylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-ethyl-5-[5-(4-methoxypiperidin-1-yl)sulfonyl-2-propoxyphenyl]-2-(pyridin-2-ylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-ethyl-5-[5-(4-methoxypiperidino)sulfonyl-2-propoxy-phenyl]-2-(2-pyridylmethyl)-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C28H34N6O5S MolecularWeight: 566.67176

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)OC)C3=NC(=O)C4=NN(C(=C4N3)CC)CC5=CC=CC=N5

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)OC)C3=NC(=O)C4=NN(C(=C4N3)CC)CC5=CC=CC=N5

InChI

InChI=1S/C28H34N6O5S/c1-4-16-39-24-10-9-21(40(36,37)33-14-11-20(38-3)12-15-33)17-22(24)27-30-25-23(5-2)34(32-26(25)28(35)31-27)18-19-8-6-7-13-29-19/h6-10,13,17,20H,4-5,11-12,14-16,18H2,1-3H3,(H,30,31,35)