2-(cyclobutylmethyl)-5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 2-(cyclobutylmethyl)-5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 2-(cyclobutylmethyl)-5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 2-(cyclobutylmethyl)-5-[2-ethoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 2-(cyclobutylmethyl)-5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 2-(cyclobutylmethyl)-5-[2-ethoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C26H36N6O4S MolecularWeight: 528.66684

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=NN1CC3CCC3)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCC

Isomeric SMILES

CCCC1=C2C(=NN1CC3CCC3)C(=O)N=C(N2)C4=C(C=CC(=C4)S(=O)(=O)N5CCN(CC5)C)OCC

InChI

InChI=1S/C26H36N6O4S/c1-4-7-21-23-24(29-32(21)17-18-8-6-9-18)26(33)28-25(27-23)20-16-19(10-11-22(20)36-5-2)37(34,35)31-14-12-30(3)13-15-31/h10-11,16,18H,4-9,12-15,17H2,1-3H3,(H,27,28,33)