1-(4-bromanyl-3-fluoranyl-phenyl)-4-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]oxy-6-oxidanylidene-pyridazine-3-carbonitrile

Systemtic Name: 1-(4-bromanyl-3-fluoranyl-phenyl)-4-[1-(5-chloranylpyrimidin-2-yl)piperidin-4-yl]oxy-6-oxidanylidene-pyridazine-3-carbonitrile Openeye Name: 1-(4-bromo-3-fluoro-phenyl)-4-[[1-(5-chloropyrimidin-2-yl)-4-piperidyl]oxy]-6-oxo-pyridazine-3-carbonitrile CAS Name: 1-(4-bromo-3-fluorophenyl)-4-[[1-(5-chloro-2-pyrimidinyl)-4-piperidinyl]oxy]-6-oxo-3-pyridazinecarbonitrile IUPAC Name: 1-(4-bromo-3-fluorophenyl)-4-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-6-oxopyridazine-3-carbonitrile Traditional Name: 1-(4-bromo-3-fluoro-phenyl)-4-[[1-(5-chloropyrimidin-2-yl)-4-piperidyl]oxy]-6-keto-pyridazine-3-carbonitrile Formula: C20H15BrClFN6O2 MolecularWeight: 505.727503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC(=O)N(N=C2C#N)C3=CC(=C(C=C3)Br)F)C4=NC=C(C=N4)Cl

Isomeric SMILES

C1CN(CCC1OC2=CC(=O)N(N=C2C#N)C3=CC(=C(C=C3)Br)F)C4=NC=C(C=N4)Cl

InChI

InChI=1S/C20H15BrClFN6O2/c21-15-2-1-13(7-16(15)23)29-19(30)8-18(17(9-24)27-29)31-14-3-5-28(6-4-14)20-25-10-12(22)11-26-20/h1-2,7-8,10-11,14H,3-6H2