4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-N-(3-morpholinopropyl)phthalazine-1-carboxamide CAS Name: 4-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-N-[3-(4-morpholinyl)propyl]-1-phthalazinecarboxamide IUPAC Name: 4-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazino]-N-(3-morpholinopropyl)phthalazine-1-carboxamide Formula: C27H33ClN6O3 MolecularWeight: 525.04232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCCN5CCOCC5

InChI

InChI=1S/C27H33ClN6O3/c1-36-24-8-7-20(28)19-23(24)33-11-13-34(14-12-33)26-22-6-3-2-5-21(22)25(30-31-26)27(35)29-9-4-10-32-15-17-37-18-16-32/h2-3,5-8,19H,4,9-18H2,1H3,(H,29,35)