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

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-[2-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinyl]butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1S)-2-methyl-1-[[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]carbamoyl]propyl]cyclohexanecarboxamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]butan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-[2-(4-oxo-3-pentylphthalazine-1-carbonyl)hydrazinyl]butan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1S)-1-[[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-2-methyl-propyl]cyclohexanecarboxamide Formula: C26H37N5O4 MolecularWeight: 483.60308

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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)C3CCCCC3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)[C@H](C(C)C)NC(=O)C3CCCCC3

InChI

InChI=1S/C26H37N5O4/c1-4-5-11-16-31-26(35)20-15-10-9-14-19(20)22(30-31)25(34)29-28-24(33)21(17(2)3)27-23(32)18-12-7-6-8-13-18/h9-10,14-15,17-18,21H,4-8,11-13,16H2,1-3H3,(H,27,32)(H,28,33)(H,29,34)/t21-/m0/s1