5-[2-(4-cyclopropylsulfonylpiperazin-1-yl)ethyl-(2-methylpropyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[2-(4-cyclopropylsulfonylpiperazin-1-yl)ethyl-(2-methylpropyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-[2-(4-cyclopropylsulfonylpiperazin-1-yl)ethyl-isobutyl-amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-[2-(4-cyclopropylsulfonyl-1-piperazinyl)ethyl-(2-methylpropyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-[2-(4-cyclopropylsulfonylpiperazin-1-yl)ethyl-(2-methylpropyl)amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-[2-(4-cyclopropylsulfonylpiperazino)ethyl-isobutyl-amino]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C22H37N7O3S MolecularWeight: 479.63928

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)N(CCN3CCN(CC3)S(=O)(=O)C4CC4)CC(C)C)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)N(CCN3CCN(CC3)S(=O)(=O)C4CC4)CC(C)C)C

InChI

InChI=1S/C22H37N7O3S/c1-5-6-18-19-20(26(4)25-18)21(30)24-22(23-19)28(15-16(2)3)12-9-27-10-13-29(14-11-27)33(31,32)17-7-8-17/h16-17H,5-15H2,1-4H3,(H,23,24,30)