2-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[2-(1-isopentyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[2-[2,5-dimethyl-1-(3-methylbutyl)-3-pyrrolyl]-2-oxoethyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[2-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]-2-oxoethyl]-6-phenylpyridazin-3-one Traditional Name: 2-[2-(1-isoamyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-6-phenyl-pyridazin-3-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(C)C)C)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CCC(C)C)C)C(=O)CN2C(=O)C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O2/c1-16(2)12-13-25-17(3)14-20(18(25)4)22(27)15-26-23(28)11-10-21(24-26)19-8-6-5-7-9-19/h5-11,14,16H,12-13,15H2,1-4H3