ethyl 4-[2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[(2-phenyl-6-imidazo[1,2-b]pyridazinyl)thio]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-phenylimidazo[1,2-b]pyridazin-6-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(2-phenylimidazo[1,2-b]pyridazin-6-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN3C=C(N=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN3C=C(N=C3C=C2)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O3S/c1-2-30-23(29)17-8-10-18(11-9-17)24-21(28)15-31-22-13-12-20-25-19(14-27(20)26-22)16-6-4-3-5-7-16/h3-14H,2,15H2,1H3,(H,24,28)