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

Systemtic Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridin-3-yl]-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-methoxyethoxy)-3-pyridyl]-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-6-[5-[(4-ethyl-1-piperazinyl)sulfonyl]-2-(2-methoxyethoxy)-3-pyridinyl]-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-6-[5-(4-ethylpiperazin-1-yl)sulfonyl-2-(2-methoxyethoxy)pyridin-3-yl]-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-6-[5-(4-ethylpiperazino)sulfonyl-2-(2-methoxyethoxy)-3-pyridyl]-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C27H33N7O5S MolecularWeight: 567.65982

Click to see the large picture

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)OCCOC

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)OCCOC

InChI

InChI=1S/C27H33N7O5S/c1-4-32-11-13-33(14-12-32)40(36,37)20-17-21(27(28-18-20)39-16-15-38-3)24-29-25-22(26(35)30-24)23(31-34(25)5-2)19-9-7-6-8-10-19/h6-10,17-18,31H,4-5,11-16H2,1-3H3