6-(4-chlorophenyl)-2-[6-[(3R)-3-morpholin-4-ylpyrrolidin-1-yl]pyridin-3-yl]phthalazin-1-one

Systemtic Name: 6-(4-chlorophenyl)-2-[6-[(3R)-3-morpholin-4-ylpyrrolidin-1-yl]pyridin-3-yl]phthalazin-1-one Openeye Name: 6-(4-chlorophenyl)-2-[6-[(3R)-3-morpholinopyrrolidin-1-yl]-3-pyridyl]phthalazin-1-one CAS Name: 6-(4-chlorophenyl)-2-[6-[(3R)-3-(4-morpholinyl)-1-pyrrolidinyl]-3-pyridinyl]-1-phthalazinone IUPAC Name: 6-(4-chlorophenyl)-2-[6-[(3R)-3-morpholin-4-ylpyrrolidin-1-yl]pyridin-3-yl]phthalazin-1-one Traditional Name: 6-(4-chlorophenyl)-2-[6-[(3R)-3-morpholinopyrrolidino]-3-pyridyl]phthalazin-1-one Formula: C27H26ClN5O2 MolecularWeight: 487.98064

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N2CCOCC2)C3=NC=C(C=C3)N4C(=O)C5=C(C=C(C=C5)C6=CC=C(C=C6)Cl)C=N4

Isomeric SMILES

C1CN(C[C@@H]1N2CCOCC2)C3=NC=C(C=C3)N4C(=O)C5=C(C=C(C=C5)C6=CC=C(C=C6)Cl)C=N4

InChI

InChI=1S/C27H26ClN5O2/c28-22-4-1-19(2-5-22)20-3-7-25-21(15-20)16-30-33(27(25)34)23-6-8-26(29-17-23)32-10-9-24(18-32)31-11-13-35-14-12-31/h1-8,15-17,24H,9-14,18H2/t24-/m1/s1