3-methyl-4-oxidanylidene-N-[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[(2S)-2-phenyl-2-pyrrolidin-1-yl-ethyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[(2S)-2-phenyl-2-(1-pyrrolidinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(2S)-2-phenyl-2-pyrrolidino-ethyl]phthalazine-1-carboxamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC[C@H](C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C22H24N4O2/c1-25-22(28)18-12-6-5-11-17(18)20(24-25)21(27)23-15-19(26-13-7-8-14-26)16-9-3-2-4-10-16/h2-6,9-12,19H,7-8,13-15H2,1H3,(H,23,27)/t19-/m1/s1