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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3/c1-14(2)19(26)22-12-13-23-20(27)18-16-10-6-7-11-17(16)21(28)25(24-18)15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3,(H,22,26)(H,23,27)