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

Systemtic Name: N-[(4-aminocarbonylphenyl)methyl]-N-methyl-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[(4-carbamoylphenyl)methyl]-3-isopropyl-N-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(4-carbamoylphenyl)methyl]-N-methyl-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(4-carbamoylphenyl)methyl]-N-methyl-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-(4-carbamoylbenzyl)-3-isopropyl-4-keto-N-methyl-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)N(C)CC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC=C(C=C3)C(=O)N

InChI

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