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

Systemtic Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-1-ethyl-3-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C26H30N6O4S MolecularWeight: 522.6192

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=NC(=O)C2=C(N1)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCC

Isomeric SMILES

CCN1C2=NC(=NC(=O)C2=C(N1)C3=CC=CC=C3)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCC

InChI

InChI=1S/C26H30N6O4S/c1-4-32-25-22(23(29-32)18-9-7-6-8-10-18)26(33)28-24(27-25)20-17-19(11-12-21(20)36-5-2)37(34,35)31-15-13-30(3)14-16-31/h6-12,17,29H,4-5,13-16H2,1-3H3