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

Systemtic Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[(1-methylimidazol-2-yl)-phenyl-methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1-methyl-2-imidazolyl)-phenylmethyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[(1-methylimidazol-2-yl)-phenylmethyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[(1-methylimidazol-2-yl)-phenyl-methyl]phthalazine-1-carboxamide Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C3=CC=CC=C3)C4=NC=CN4C

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C3=CC=CC=C3)C4=NC=CN4C

InChI

InChI=1S/C23H23N5O2/c1-15(2)28-23(30)18-12-8-7-11-17(18)20(26-28)22(29)25-19(16-9-5-4-6-10-16)21-24-13-14-27(21)3/h4-15,19H,1-3H3,(H,25,29)