3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-yl-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-morpholino-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(2S)-2-(5-methyl-2-furanyl)-2-(4-morpholinyl)ethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(2S)-2-(5-methyl-2-furyl)-2-morpholino-ethyl]phthalazine-1-carboxamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)N4CCOCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)N4CCOCC4

InChI

InChI=1S/C21H24N4O4/c1-14-7-8-18(29-14)17(25-9-11-28-12-10-25)13-22-20(26)19-15-5-3-4-6-16(15)21(27)24(2)23-19/h3-8,17H,9-13H2,1-2H3,(H,22,26)/t17-/m0/s1