5-[(4-bromanylnaphthalen-1-yl)methyl]-3-but-2-ynyl-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one

Systemtic Name: 5-[(4-bromanylnaphthalen-1-yl)methyl]-3-but-2-ynyl-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one Openeye Name: 5-[(4-bromo-1-naphthyl)methyl]-3-but-2-ynyl-2-piperazin-1-yl-imidazo[4,5-d]pyridazin-4-one CAS Name: 5-[(4-bromo-1-naphthalenyl)methyl]-3-but-2-ynyl-2-(1-piperazinyl)-4-imidazo[4,5-d]pyridazinone IUPAC Name: 5-[(4-bromonaphthalen-1-yl)methyl]-3-but-2-ynyl-2-piperazin-1-ylimidazo[4,5-d]pyridazin-4-one Traditional Name: 5-[(4-bromo-1-naphthyl)methyl]-3-but-2-ynyl-2-piperazino-imidazo[4,5-d]pyridazin-4-one Formula: C24H23BrN6O MolecularWeight: 491.38302

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(C=NN(C2=O)CC3=CC=C(C4=CC=CC=C34)Br)N=C1N5CCNCC5

Isomeric SMILES

CC#CCN1C2=C(C=NN(C2=O)CC3=CC=C(C4=CC=CC=C34)Br)N=C1N5CCNCC5

InChI

InChI=1S/C24H23BrN6O/c1-2-3-12-30-22-21(28-24(30)29-13-10-26-11-14-29)15-27-31(23(22)32)16-17-8-9-20(25)19-7-5-4-6-18(17)19/h4-9,15,26H,10-14,16H2,1H3