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

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[[3-(methylcarbamoyl)phenyl]methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[3-(methylcarbamoyl)benzyl]phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC(=C3)C(=O)NC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=CC(=C3)C(=O)NC

InChI

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