2-ethyl-N-[3-fluoranyl-4-[4-[oxolan-3-yl(phenyl)methyl]piperazin-1-yl]phenyl]butanamide

Systemtic Name: 2-ethyl-N-[3-fluoranyl-4-[4-[oxolan-3-yl(phenyl)methyl]piperazin-1-yl]phenyl]butanamide Openeye Name: 2-ethyl-N-[3-fluoro-4-[4-[phenyl(tetrahydrofuran-3-yl)methyl]piperazin-1-yl]phenyl]butanamide CAS Name: 2-ethyl-N-[3-fluoro-4-[4-[3-oxolanyl(phenyl)methyl]-1-piperazinyl]phenyl]butanamide IUPAC Name: 2-ethyl-N-[3-fluoro-4-[4-[oxolan-3-yl(phenyl)methyl]piperazin-1-yl]phenyl]butanamide Traditional Name: 2-ethyl-N-[3-fluoro-4-[4-[phenyl(tetrahydrofuran-3-yl)methyl]piperazino]phenyl]butyramide Formula: C27H36FN3O2 MolecularWeight: 453.592043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(C3CCOC3)C4=CC=CC=C4)F

Isomeric SMILES

CCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C(C3CCOC3)C4=CC=CC=C4)F

InChI

InChI=1S/C27H36FN3O2/c1-3-20(4-2)27(32)29-23-10-11-25(24(28)18-23)30-13-15-31(16-14-30)26(22-12-17-33-19-22)21-8-6-5-7-9-21/h5-11,18,20,22,26H,3-4,12-17,19H2,1-2H3,(H,29,32)