[4-[2-tert-butyl-5-(4-methylsulfonylphenyl)-3-oxidanylidene-pyridazin-4-yl]oxy-2-methyl-butan-2-yl] 2-azanylethanoate

Systemtic Name: [4-[2-tert-butyl-5-(4-methylsulfonylphenyl)-3-oxidanylidene-pyridazin-4-yl]oxy-2-methyl-butan-2-yl] 2-azanylethanoate Openeye Name: [3-[2-tert-butyl-5-(4-methylsulfonylphenyl)-3-oxo-pyridazin-4-yl]oxy-1,1-dimethyl-propyl] 2-aminoacetate CAS Name: 2-aminoacetic acid [4-[[2-tert-butyl-5-(4-methylsulfonylphenyl)-3-oxo-4-pyridazinyl]oxy]-2-methylbutan-2-yl] ester IUPAC Name: [4-[2-tert-butyl-5-(4-methylsulfonylphenyl)-3-oxopyridazin-4-yl]oxy-2-methylbutan-2-yl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [3-[2-tert-butyl-3-keto-5-(4-mesylphenyl)pyridazin-4-yl]oxy-1,1-dimethyl-propyl] ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)C2=CC=C(C=C2)S(=O)(=O)C)OCCC(C)(C)OC(=O)CN

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)C2=CC=C(C=C2)S(=O)(=O)C)OCCC(C)(C)OC(=O)CN

InChI

InChI=1S/C22H31N3O6S/c1-21(2,3)25-20(27)19(30-12-11-22(4,5)31-18(26)13-23)17(14-24-25)15-7-9-16(10-8-15)32(6,28)29/h7-10,14H,11-13,23H2,1-6H3