4-oxidanylidene-3-propan-2-yl-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propan-2-yl-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propan-2-yl-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propan-2-yl-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]phthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(E)-(3,3,5-trimethylcyclohexylidene)amino]phthalazine-1-carboxamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)CC(C1)(C)C

Isomeric SMILES

CC1C/C(=N\NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C)/CC(C1)(C)C

InChI

InChI=1S/C21H28N4O2/c1-13(2)25-20(27)17-9-7-6-8-16(17)18(24-25)19(26)23-22-15-10-14(3)11-21(4,5)12-15/h6-9,13-14H,10-12H2,1-5H3,(H,23,26)/b22-15+