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

Systemtic Name: N-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]phthalazine-1-carboxamide Openeye Name: 3-[2-(4-isopropylanilino)-2-oxo-ethyl]-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-3-[2-oxo-2-(4-propan-2-ylanilino)ethyl]-1-phthalazinecarboxamide IUPAC Name: N-methyl-4-oxo-3-[2-oxo-2-(4-propan-2-ylanilino)ethyl]phthalazine-1-carboxamide Traditional Name: 3-(2-cumidino-2-keto-ethyl)-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC

InChI

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