3-(2-methylpropyl)-4-oxidanylidene-N-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-N-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phthalazine-1-carboxamide Openeye Name: 3-isobutyl-4-oxo-N-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-N-[2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-4-oxo-N-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-[2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]phthalazine-1-carboxamide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C21H26N6O3/c1-12(2)11-27-21(30)16-9-7-6-8-15(16)19(25-27)20(29)22-10-17(28)23-18-13(3)24-26(5)14(18)4/h6-9,12H,10-11H2,1-5H3,(H,22,29)(H,23,28)