tert-butyl N-[(1S)-1-[5-[[5-methyl-2,4-bis(oxidanylidene)-3-(phenylcarbonyl)pyrimidin-1-yl]methyl]-1,2-oxazol-3-yl]-2-phenyl-ethyl]carbamate

Systemtic Name: tert-butyl N-[(1S)-1-[5-[[5-methyl-2,4-bis(oxidanylidene)-3-(phenylcarbonyl)pyrimidin-1-yl]methyl]-1,2-oxazol-3-yl]-2-phenyl-ethyl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[5-[(3-benzoyl-5-methyl-2,4-dioxo-pyrimidin-1-yl)methyl]isoxazol-3-yl]-2-phenyl-ethyl]carbamate CAS Name: N-[(1S)-1-[5-[(3-benzoyl-5-methyl-2,4-dioxo-1-pyrimidinyl)methyl]-3-isoxazolyl]-2-phenylethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S)-1-[5-[(3-benzoyl-5-methyl-2,4-dioxopyrimidin-1-yl)methyl]-1,2-oxazol-3-yl]-2-phenylethyl]carbamate Traditional Name: N-[(1S)-1-[5-[(3-benzoyl-2,4-diketo-5-methyl-pyrimidin-1-yl)methyl]isoxazol-3-yl]-2-phenyl-ethyl]carbamic acid tert-butyl ester Formula: C29H30N4O6 MolecularWeight: 530.5717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)CC3=CC(=NO3)C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CN(C(=O)N(C1=O)C(=O)C2=CC=CC=C2)CC3=CC(=NO3)[C@H](CC4=CC=CC=C4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C29H30N4O6/c1-19-17-32(28(37)33(25(19)34)26(35)21-13-9-6-10-14-21)18-22-16-24(31-39-22)23(15-20-11-7-5-8-12-20)30-27(36)38-29(2,3)4/h5-14,16-17,23H,15,18H2,1-4H3,(H,30,36)/t23-/m0/s1