methyl 4-[3-[3,5-dimethyl-1-(6-morpholin-4-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate

Systemtic Name: methyl 4-[3-[3,5-dimethyl-1-(6-morpholin-4-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Openeye Name: methyl 4-[3-[3,5-dimethyl-1-(6-morpholinopyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate CAS Name: 4-[[3-[3,5-dimethyl-1-[6-(4-morpholinyl)-3-pyridazinyl]-4-pyrazolyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[3,5-dimethyl-1-(6-morpholin-4-ylpyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoate Traditional Name: 4-[3-[3,5-dimethyl-1-(6-morpholinopyridazin-3-yl)pyrazol-4-yl]propanoylamino]benzoic acid methyl ester Formula: C24H28N6O4 MolecularWeight: 464.51692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NN=C(C=C2)N3CCOCC3)C)CCC(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=NN=C(C=C2)N3CCOCC3)C)CCC(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C24H28N6O4/c1-16-20(8-11-23(31)25-19-6-4-18(5-7-19)24(32)33-3)17(2)30(28-16)22-10-9-21(26-27-22)29-12-14-34-15-13-29/h4-7,9-10H,8,11-15H2,1-3H3,(H,25,31)