2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxidanylidene-ethyl]-5,6-dimethyl-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-[2-(2,4-diisopropylphenyl)-2-oxo-ethyl]-5,6-dimethyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl]-5,6-dimethyl-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 2-[2-[2,4-di(propan-2-yl)phenyl]-2-oxoethyl]-5,6-dimethyl-3-oxopyridazine-4-carbonitrile Traditional Name: 2-[2-(2,4-diisopropylphenyl)-2-keto-ethyl]-3-keto-5,6-dimethyl-pyridazine-4-carbonitrile Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC(=O)C2=C(C=C(C=C2)C(C)C)C(C)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC(=O)C2=C(C=C(C=C2)C(C)C)C(C)C)C#N

InChI

InChI=1S/C21H25N3O2/c1-12(2)16-7-8-17(18(9-16)13(3)4)20(25)11-24-21(26)19(10-22)14(5)15(6)23-24/h7-9,12-13H,11H2,1-6H3