1,3-dimethyl-5-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1,3-dimethyl-5-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(4-benzylsulfonylpiperazin-1-yl)-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1,3-dimethyl-5-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-6-propyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(4-benzylsulfonylpiperazin-1-yl)-1,3-dimethyl-6-propylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 5-(4-benzylsulfonylpiperazino)-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N6O3S/c1-4-10-27-20(28)19-18(16(2)23-24(19)3)22-21(27)25-11-13-26(14-12-25)31(29,30)15-17-8-6-5-7-9-17/h5-9H,4,10-15H2,1-3H3