4-azanyl-1-[2,2-bis(fluoranyl)-3-phenylmethoxy-1-(2-phenylmethoxyethoxy)propyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[2,2-bis(fluoranyl)-3-phenylmethoxy-1-(2-phenylmethoxyethoxy)propyl]pyrimidin-2-one Openeye Name: 4-amino-1-[3-benzyloxy-1-(2-benzyloxyethoxy)-2,2-difluoro-propyl]pyrimidin-2-one CAS Name: 4-amino-1-[2,2-difluoro-3-phenylmethoxy-1-(2-phenylmethoxyethoxy)propyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[2,2-difluoro-3-phenylmethoxy-1-(2-phenylmethoxyethoxy)propyl]pyrimidin-2-one Traditional Name: 4-amino-1-[3-benzoxy-1-(2-benzoxyethoxy)-2,2-difluoro-propyl]pyrimidin-2-one Formula: C23H25F2N3O4 MolecularWeight: 445.459106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCOC(C(COCC2=CC=CC=C2)(F)F)N3C=CC(=NC3=O)N

Isomeric SMILES

C1=CC=C(C=C1)COCCOC(C(COCC2=CC=CC=C2)(F)F)N3C=CC(=NC3=O)N

InChI

InChI=1S/C23H25F2N3O4/c24-23(25,17-31-16-19-9-5-2-6-10-19)21(28-12-11-20(26)27-22(28)29)32-14-13-30-15-18-7-3-1-4-8-18/h1-12,21H,13-17H2,(H2,26,27,29)