N-methyl-4-oxidanylidene-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[2-(isopropylamino)-2-oxo-ethyl]-N-methyl-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-methyl-4-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-phenylphthalazine-1-carboxamide Traditional Name: N-[2-(isopropylamino)-2-keto-ethyl]-4-keto-N-methyl-3-phenyl-phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN(C)C(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)CN(C)C(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3/c1-14(2)22-18(26)13-24(3)21(28)19-16-11-7-8-12-17(16)20(27)25(23-19)15-9-5-4-6-10-15/h4-12,14H,13H2,1-3H3,(H,22,26)