5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1-ethyl-3-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-pyridin-3-yl]-1-ethyl-3-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-3-pyridyl]-1-ethyl-3-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-ethoxy-5-[(4-ethyl-1-piperazinyl)sulfonyl]-3-pyridinyl]-1-ethyl-3-(2-pyrazinyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylpyridin-3-yl]-1-ethyl-3-pyrazin-2-ylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-ethoxy-5-(4-ethylpiperazino)sulfonyl-3-pyridyl]-1-ethyl-3-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C24H29N9O4S MolecularWeight: 539.60996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)N3C=NC4=C(C3=O)C(=NN4CC)C5=NC=CN=C5)OCC

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CN=C(C(=C2)N3C=NC4=C(C3=O)C(=NN4CC)C5=NC=CN=C5)OCC

InChI

InChI=1S/C24H29N9O4S/c1-4-30-9-11-31(12-10-30)38(35,36)17-13-19(23(27-14-17)37-6-3)32-16-28-22-20(24(32)34)21(29-33(22)5-2)18-15-25-7-8-26-18/h7-8,13-16H,4-6,9-12H2,1-3H3