N-[4-(tert-butylcarbamoyl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-[(tert-butylamino)-oxomethyl]phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-(tert-butylcarbamoyl)phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O3/c1-26(2,3)28-23(31)17-13-15-18(16-14-17)27-24(32)22-20-11-7-8-12-21(20)25(33)30(29-22)19-9-5-4-6-10-19/h4-16H,1-3H3,(H,27,32)(H,28,31)