N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)Cl)N4CCOCC4

InChI

InChI=1S/C22H23ClN4O3/c1-14(2)27-22(29)17-6-4-3-5-16(17)20(25-27)21(28)24-18-13-15(23)7-8-19(18)26-9-11-30-12-10-26/h3-8,13-14H,9-12H2,1-2H3,(H,24,28)