tert-butyl (NE)-N-[[[3-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1,2-oxazol-5-yl]amino]-(4-oxidanylidenepiperidin-1-yl)methylidene]carbamate

Systemtic Name: tert-butyl (NE)-N-[[[3-[1-(3-fluoranyl-4-phenyl-phenyl)ethyl]-1,2-oxazol-5-yl]amino]-(4-oxidanylidenepiperidin-1-yl)methylidene]carbamate Openeye Name: tert-butyl (NE)-N-[[[3-[1-(3-fluoro-4-phenyl-phenyl)ethyl]isoxazol-5-yl]amino]-(4-oxo-1-piperidyl)methylene]carbamate CAS Name: (NE)-N-[[[3-[1-(3-fluoro-4-phenylphenyl)ethyl]-5-isoxazolyl]amino]-(4-oxo-1-piperidinyl)methylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NE)-N-[[[3-[1-(3-fluoro-4-phenylphenyl)ethyl]-1,2-oxazol-5-yl]amino]-(4-oxopiperidin-1-yl)methylidene]carbamate Traditional Name: (NE)-N-[[[3-[1-(3-fluoro-4-phenyl-phenyl)ethyl]isoxazol-5-yl]amino]-(4-ketopiperidino)methylene]carbamic acid tert-butyl ester Formula: C28H31FN4O4 MolecularWeight: 506.568543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NOC(=C3)NC(=NC(=O)OC(C)(C)C)N4CCC(=O)CC4

Isomeric SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C3=NOC(=C3)N/C(=N\C(=O)OC(C)(C)C)/N4CCC(=O)CC4

InChI

InChI=1S/C28H31FN4O4/c1-18(20-10-11-22(23(29)16-20)19-8-6-5-7-9-19)24-17-25(37-32-24)30-26(31-27(35)36-28(2,3)4)33-14-12-21(34)13-15-33/h5-11,16-18H,12-15H2,1-4H3,(H,30,31,35)