N-[(2S)-1-oxidanylidene-1-[2-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylhydrazinyl]propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-oxidanylidene-1-[2-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylhydrazinyl]propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-[2-(3-benzyl-4-oxo-phthalazine-1-carbonyl)hydrazino]-1-methyl-2-oxo-ethyl]acetamide CAS Name: N-[(2S)-1-oxo-1-[[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]hydrazo]propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-[2-(3-benzyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-1-oxopropan-2-yl]acetamide Traditional Name: N-[(1S)-2-[N'-(3-benzyl-4-keto-phthalazine-1-carbonyl)hydrazino]-2-keto-1-methyl-ethyl]acetamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

C[C@@H](C(=O)NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C21H21N5O4/c1-13(22-14(2)27)19(28)23-24-20(29)18-16-10-6-7-11-17(16)21(30)26(25-18)12-15-8-4-3-5-9-15/h3-11,13H,12H2,1-2H3,(H,22,27)(H,23,28)(H,24,29)/t13-/m0/s1