tert-butyl N-[3-[[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]carbamate CAS Name: N-[3-[oxo-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]hydrazo]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[(4-oxo-3-propylphthalazine-1-carbonyl)amino]carbamoyl]phenyl]carbamate Traditional Name: N-[3-[[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C24H27N5O5 MolecularWeight: 465.50168

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC(=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H27N5O5/c1-5-13-29-22(32)18-12-7-6-11-17(18)19(28-29)21(31)27-26-20(30)15-9-8-10-16(14-15)25-23(33)34-24(2,3)4/h6-12,14H,5,13H2,1-4H3,(H,25,33)(H,26,30)(H,27,31)