2-(3-azanylpiperidin-1-yl)-3-(3-methylbut-2-enyl)-5-phenacyl-imidazo[4,5-d]pyridazin-4-one

Systemtic Name: 2-(3-azanylpiperidin-1-yl)-3-(3-methylbut-2-enyl)-5-phenacyl-imidazo[4,5-d]pyridazin-4-one Openeye Name: 2-(3-amino-1-piperidyl)-3-(3-methylbut-2-enyl)-5-phenacyl-imidazo[4,5-d]pyridazin-4-one CAS Name: 2-(3-amino-1-piperidinyl)-3-(3-methylbut-2-enyl)-5-phenacyl-4-imidazo[4,5-d]pyridazinone IUPAC Name: 2-(3-aminopiperidin-1-yl)-3-(3-methylbut-2-enyl)-5-phenacylimidazo[4,5-d]pyridazin-4-one Traditional Name: 2-(3-aminopiperidino)-3-(3-methylbut-2-enyl)-5-phenacyl-imidazo[4,5-d]pyridazin-4-one Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(C=NN(C2=O)CC(=O)C3=CC=CC=C3)N=C1N4CCCC(C4)N)C

Isomeric SMILES

CC(=CCN1C2=C(C=NN(C2=O)CC(=O)C3=CC=CC=C3)N=C1N4CCCC(C4)N)C

InChI

InChI=1S/C23H28N6O2/c1-16(2)10-12-28-21-19(26-23(28)27-11-6-9-18(24)14-27)13-25-29(22(21)31)15-20(30)17-7-4-3-5-8-17/h3-5,7-8,10,13,18H,6,9,11-12,14-15,24H2,1-2H3