3,5,7-trimethyl-1-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]-6-phenyl-pyrrolo[3,4-d]pyridazin-4-one

Systemtic Name: 3,5,7-trimethyl-1-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]-6-phenyl-pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-3,5,7-trimethyl-6-phenyl-pyrrolo[3,4-d]pyridazin-4-one CAS Name: 1-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-3,5,7-trimethyl-6-phenyl-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-3,5,7-trimethyl-6-phenylpyrrolo[3,4-d]pyridazin-4-one Traditional Name: 1-[2-hydroxy-3-(4-phenylpiperazino)propoxy]-3,5,7-trimethyl-6-phenyl-pyrrolo[3,4-d]pyridazin-4-one Formula: C28H33N5O3 MolecularWeight: 487.59332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1C3=CC=CC=C3)C)C(=O)N(N=C2OCC(CN4CCN(CC4)C5=CC=CC=C5)O)C

Isomeric SMILES

CC1=C2C(=C(N1C3=CC=CC=C3)C)C(=O)N(N=C2OCC(CN4CCN(CC4)C5=CC=CC=C5)O)C

InChI

InChI=1S/C28H33N5O3/c1-20-25-26(21(2)33(20)23-12-8-5-9-13-23)28(35)30(3)29-27(25)36-19-24(34)18-31-14-16-32(17-15-31)22-10-6-4-7-11-22/h4-13,24,34H,14-19H2,1-3H3