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

Systemtic Name: 5-[2-ethoxy-5-(4-naphthalen-1-ylpiperazin-1-yl)sulfonyl-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-ethoxy-5-[4-(1-naphthyl)piperazin-1-yl]sulfonyl-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-ethoxy-5-[[4-(1-naphthalenyl)-1-piperazinyl]sulfonyl]phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[2-ethoxy-5-(4-naphthalen-1-ylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[2-ethoxy-5-[4-(1-naphthyl)piperazino]sulfonyl-phenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C31H34N6O4S MolecularWeight: 586.70446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC6=CC=CC=C65)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C5=CC=CC6=CC=CC=C65)OCC)C

InChI

InChI=1S/C31H34N6O4S/c1-4-9-25-28-29(35(3)34-25)31(38)33-30(32-28)24-20-22(14-15-27(24)41-5-2)42(39,40)37-18-16-36(17-19-37)26-13-8-11-21-10-6-7-12-23(21)26/h6-8,10-15,20H,4-5,9,16-19H2,1-3H3,(H,32,33,38)