6-[4-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethylcarbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethylcarbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethylcarbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[[2-(4-tert-butyl-2,6-dimethylphenyl)ethylamino]-oxomethyl]-5-methyl-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-[2-(4-tert-butyl-2,6-dimethylphenyl)ethylcarbamoyl]-5-methylpyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[4-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethylcarbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Formula: C23H28N5O2- MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CCNC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)[O-])C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CCNC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)[O-])C)C)C(C)(C)C

InChI

InChI=1S/C23H29N5O2/c1-14-11-17(23(4,5)6)12-15(2)18(14)9-10-24-22(30)19-13-25-28(16(19)3)20-7-8-21(29)27-26-20/h7-8,11-13H,9-10H2,1-6H3,(H,24,30)(H,27,29)/p-1