2-methyl-2-(2-morpholin-4-ylethylsulfanyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]propanamide

Systemtic Name: 2-methyl-2-(2-morpholin-4-ylethylsulfanyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]propanamide Openeye Name: 2-methyl-2-(2-morpholinoethylsulfanyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]propanamide CAS Name: 2-methyl-2-[2-(4-morpholinyl)ethylthio]-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]propanamide IUPAC Name: 2-methyl-2-(2-morpholin-4-ylethylsulfanyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]propanamide Traditional Name: N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]-2-methyl-2-(2-morpholinoethylthio)propionamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)SCCN4CCOCC4

Isomeric SMILES

CC(C)(C(=O)NC1=CC=CC(=C1)C2=NNC(=O)C3=CC=CC=C32)SCCN4CCOCC4

InChI

InChI=1S/C24H28N4O3S/c1-24(2,32-15-12-28-10-13-31-14-11-28)23(30)25-18-7-5-6-17(16-18)21-19-8-3-4-9-20(19)22(29)27-26-21/h3-9,16H,10-15H2,1-2H3,(H,25,30)(H,27,29)