(2S)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-methyl-propanamide

Systemtic Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-methyl-propanamide Openeye Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]-N-methyl-propanamide CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]-N-methylpropanamide IUPAC Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide Traditional Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]-N-methyl-propionamide Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)C(C)C(=O)NC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)[C@@H](C)C(=O)NC

InChI

InChI=1S/C20H21N3O2/c1-12-9-10-13(2)17(11-12)18-15-7-5-6-8-16(15)20(25)23(22-18)14(3)19(24)21-4/h5-11,14H,1-4H3,(H,21,24)/t14-/m0/s1