ethyl N-[4-methyl-1-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]pentan-2-yl]carbamate

Systemtic Name: ethyl N-[4-methyl-1-[(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonylamino]pentan-2-yl]carbamate Openeye Name: ethyl N-[1-[[(3-isopropyl-4-oxo-phthalazine-1-carbonyl)amino]methyl]-3-methyl-butyl]carbamate CAS Name: N-[4-methyl-1-[[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]amino]pentan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-methyl-1-[(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)amino]pentan-2-yl]carbamate Traditional Name: N-[1-[[(3-isopropyl-4-keto-phthalazine-1-carbonyl)amino]methyl]-3-methyl-butyl]carbamic acid ethyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(CC(C)C)CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C(C)C

Isomeric SMILES

CCOC(=O)NC(CC(C)C)CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C(C)C

InChI

InChI=1S/C21H30N4O4/c1-6-29-21(28)23-15(11-13(2)3)12-22-19(26)18-16-9-7-8-10-17(16)20(27)25(24-18)14(4)5/h7-10,13-15H,6,11-12H2,1-5H3,(H,22,26)(H,23,28)