N-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-cyclohexyl-4-[4-(2-fluorophenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-cyclohexyl-4-[4-(2-fluorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-cyclohexyl-4-[4-(2-fluorophenyl)piperazino]phthalazine-1-carboxamide Formula: C25H28FN5O MolecularWeight: 433.521123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5F

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5F

InChI

InChI=1S/C25H28FN5O/c26-21-12-6-7-13-22(21)30-14-16-31(17-15-30)24-20-11-5-4-10-19(20)23(28-29-24)25(32)27-18-8-2-1-3-9-18/h4-7,10-13,18H,1-3,8-9,14-17H2,(H,27,32)