(2S)-N-methyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-N-methyl-2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-(phenylmethyl)propanamide Openeye Name: (2S)-N-benzyl-N-methyl-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanamide CAS Name: (2S)-N-methyl-2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]-N-(phenylmethyl)propanamide IUPAC Name: (2S)-N-benzyl-N-methyl-2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanamide Traditional Name: (2S)-N-benzyl-2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]-N-methyl-propionamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)N(C)CC1=CC=CC=C1)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H22N4O3/c1-14(21(28)25(2)13-15-8-4-3-5-9-15)22-19(26)12-18-16-10-6-7-11-17(16)20(27)24-23-18/h3-11,14H,12-13H2,1-2H3,(H,22,26)(H,24,27)/t14-/m0/s1