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

Systemtic Name: 4-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-N-(tetrahydrofuran-2-ylmethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-N-(2-oxolanylmethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-N-(oxolan-2-ylmethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(5-chloro-2-methoxy-phenyl)piperazino]-N-(tetrahydrofurfuryl)phthalazine-1-carboxamide Formula: C25H28ClN5O3 MolecularWeight: 481.97452

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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)NCC5CCCO5

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)C(=O)NCC5CCCO5

InChI

InChI=1S/C25H28ClN5O3/c1-33-22-9-8-17(26)15-21(22)30-10-12-31(13-11-30)24-20-7-3-2-6-19(20)23(28-29-24)25(32)27-16-18-5-4-14-34-18/h2-3,6-9,15,18H,4-5,10-14,16H2,1H3,(H,27,32)