2-phthalazin-1-ylsulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione

Systemtic Name: 2-phthalazin-1-ylsulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione Openeye Name: 2-phthalazin-1-ylsulfanyl-1,3-bis(1-piperidyl)propane-1,3-dione CAS Name: 2-(1-phthalazinylthio)-1,3-bis(1-piperidinyl)propane-1,3-dione IUPAC Name: 2-phthalazin-1-ylsulfanyl-1,3-di(piperidin-1-yl)propane-1,3-dione Traditional Name: 2-(phthalazin-1-ylthio)-1,3-dipiperidino-propane-1,3-dione Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C(=O)N2CCCCC2)SC3=NN=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C(=O)C(C(=O)N2CCCCC2)SC3=NN=CC4=CC=CC=C43

InChI

InChI=1S/C21H26N4O2S/c26-20(24-11-5-1-6-12-24)18(21(27)25-13-7-2-8-14-25)28-19-17-10-4-3-9-16(17)15-22-23-19/h3-4,9-10,15,18H,1-2,5-8,11-14H2