N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-[3-(pivaloylamino)phenyl]phthalazine-1-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)NC(=O)C(C)(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC=C3)NC(=O)C(C)(C)C

InChI

InChI=1S/C22H24N4O3/c1-5-26-20(28)17-12-7-6-11-16(17)18(25-26)19(27)23-14-9-8-10-15(13-14)24-21(29)22(2,3)4/h6-13H,5H2,1-4H3,(H,23,27)(H,24,29)