3-(2-methylpropyl)-4-oxidanylidene-N-[(2R)-2-phenylpropyl]phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-N-[(2R)-2-phenylpropyl]phthalazine-1-carboxamide Openeye Name: 3-isobutyl-4-oxo-N-[(2R)-2-phenylpropyl]phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-N-[(2R)-2-phenylpropyl]-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-4-oxo-N-[(2R)-2-phenylpropyl]phthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-[(2R)-2-phenylpropyl]phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2/c1-15(2)14-25-22(27)19-12-8-7-11-18(19)20(24-25)21(26)23-13-16(3)17-9-5-4-6-10-17/h4-12,15-16H,13-14H2,1-3H3,(H,23,26)/t16-/m0/s1