1-[(2S)-1-[2-(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]urea

Systemtic Name: 1-[(2S)-1-[2-(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]urea Openeye Name: [(1S)-1-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]-2-methyl-propyl]urea CAS Name: [(2S)-1-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]urea IUPAC Name: [(2S)-1-[2-(3-ethyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]urea Traditional Name: [(1S)-1-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-2-methyl-propyl]urea Formula: C17H22N6O4 MolecularWeight: 374.39438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C(C(C)C)NC(=O)N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)[C@H](C(C)C)NC(=O)N

InChI

InChI=1S/C17H22N6O4/c1-4-23-16(26)11-8-6-5-7-10(11)13(22-23)15(25)21-20-14(24)12(9(2)3)19-17(18)27/h5-9,12H,4H2,1-3H3,(H,20,24)(H,21,25)(H3,18,19,27)/t12-/m0/s1