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

Systemtic Name: 4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(2-morpholin-4-ylethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-N-(2-morpholinoethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-N-[2-(4-morpholinyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 4-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-N-(2-morpholin-4-ylethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazino]-N-(2-morpholinoethyl)phthalazine-1-carboxamide Formula: C26H31ClN6O3 MolecularWeight: 511.01574

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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)NCCN5CCOCC5

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCCN5CCOCC5

InChI

InChI=1S/C26H31ClN6O3/c1-35-23-7-6-19(27)18-22(23)32-10-12-33(13-11-32)25-21-5-3-2-4-20(21)24(29-30-25)26(34)28-8-9-31-14-16-36-17-15-31/h2-7,18H,8-17H2,1H3,(H,28,34)