5-methyl-1,6-bis(phenylmethyl)-3-piperidin-1-yl-pyrazolo[3,4-d]pyridazine-4,7-dione

Systemtic Name: 5-methyl-1,6-bis(phenylmethyl)-3-piperidin-1-yl-pyrazolo[3,4-d]pyridazine-4,7-dione Openeye Name: 1,6-dibenzyl-5-methyl-3-(1-piperidyl)pyrazolo[3,4-d]pyridazine-4,7-dione CAS Name: 5-methyl-1,6-bis(phenylmethyl)-3-(1-piperidinyl)pyrazolo[3,4-d]pyridazine-4,7-dione IUPAC Name: 1,6-dibenzyl-5-methyl-3-piperidin-1-ylpyrazolo[3,4-d]pyridazine-4,7-dione Traditional Name: 1,6-dibenzyl-5-methyl-3-piperidino-pyrazolo[3,4-d]pyridazine-4,7-quinone Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C(=O)N1CC3=CC=CC=C3)N(N=C2N4CCCCC4)CC5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=C(C(=O)N1CC3=CC=CC=C3)N(N=C2N4CCCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2/c1-27-24(31)21-22(25(32)30(27)18-20-13-7-3-8-14-20)29(17-19-11-5-2-6-12-19)26-23(21)28-15-9-4-10-16-28/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3