2-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[2-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinyl]butan-2-yl]benzamide

Systemtic Name: 2-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[2-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinyl]butan-2-yl]benzamide Openeye Name: 2-methyl-N-[(1S)-2-methyl-1-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]propyl]benzamide CAS Name: 2-methyl-N-[(2S)-3-methyl-1-oxo-1-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]butan-2-yl]benzamide IUPAC Name: 2-methyl-N-[(2S)-3-methyl-1-oxo-1-[2-(4-oxo-3-pentylphthalazine-1-carbonyl)hydrazinyl]butan-2-yl]benzamide Traditional Name: N-[(1S)-1-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C(C(C)C)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)[C@H](C(C)C)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C27H33N5O4/c1-5-6-11-16-32-27(36)21-15-10-9-14-20(21)23(31-32)26(35)30-29-25(34)22(17(2)3)28-24(33)19-13-8-7-12-18(19)4/h7-10,12-15,17,22H,5-6,11,16H2,1-4H3,(H,28,33)(H,29,34)(H,30,35)/t22-/m0/s1