ethyl 4-[2-[6-(3,4,5-trimethoxyphenyl)pyridazin-3-yl]sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[6-(3,4,5-trimethoxyphenyl)pyridazin-3-yl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[6-(3,4,5-trimethoxyphenyl)pyridazin-3-yl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[[6-(3,4,5-trimethoxyphenyl)-3-pyridazinyl]thio]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[6-(3,4,5-trimethoxyphenyl)pyridazin-3-yl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[6-(3,4,5-trimethoxyphenyl)pyridazin-3-yl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(C=C2)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C24H25N3O6S/c1-5-33-24(29)15-6-8-17(9-7-15)25-21(28)14-34-22-11-10-18(26-27-22)16-12-19(30-2)23(32-4)20(13-16)31-3/h6-13H,5,14H2,1-4H3,(H,25,28)