(2S)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(3-methylphenyl)propanamide

Systemtic Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]-N-(3-methylphenyl)propanamide Openeye Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]-N-(m-tolyl)propanamide CAS Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]-N-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]-N-(m-tolyl)propionamide Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3C(=N2)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)N2C(=O)C3=CC=CC=C3C(=N2)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C26H25N3O2/c1-16-8-7-9-20(14-16)27-25(30)19(4)29-26(31)22-11-6-5-10-21(22)24(28-29)23-15-17(2)12-13-18(23)3/h5-15,19H,1-4H3,(H,27,30)/t19-/m0/s1