N-(2,4-dimethoxyphenyl)-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-(4-morpholinophthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-[[4-(4-morpholinyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-(4-morpholin-4-ylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-[(4-morpholinophthalazin-1-yl)thio]acetamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)N4CCOCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(C3=CC=CC=C32)N4CCOCC4)OC

InChI

InChI=1S/C22H24N4O4S/c1-28-15-7-8-18(19(13-15)29-2)23-20(27)14-31-22-17-6-4-3-5-16(17)21(24-25-22)26-9-11-30-12-10-26/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)