N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide

Systemtic Name: N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-(4-propan-2-ylsulfanylphenyl)ethanamide Openeye Name: 2-(4-isopropylsulfanylphenyl)-N-[3-(6-morpholinopyridazin-3-yl)phenyl]acetamide CAS Name: N-[3-[6-(4-morpholinyl)-3-pyridazinyl]phenyl]-2-[4-(propan-2-ylthio)phenyl]acetamide IUPAC Name: N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-(4-propan-2-ylsulfanylphenyl)acetamide Traditional Name: 2-[4-(isopropylthio)phenyl]-N-[3-(6-morpholinopyridazin-3-yl)phenyl]acetamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCOCC4

InChI

InChI=1S/C25H28N4O2S/c1-18(2)32-22-8-6-19(7-9-22)16-25(30)26-21-5-3-4-20(17-21)23-10-11-24(28-27-23)29-12-14-31-15-13-29/h3-11,17-18H,12-16H2,1-2H3,(H,26,30)