tert-butyl (2S)-2-[[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]azetidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]azetidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[(1S)-1-benzyl-2-[benzyl(methyl)amino]-2-oxo-ethyl]carbamoyl]azetidine-1-carboxylate CAS Name: (2S)-2-[[[(2S)-1-[methyl-(phenylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1-azetidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2S)-1-[benzyl(methyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]azetidine-1-carboxylate Traditional Name: (2S)-2-[[(1S)-1-benzyl-2-[benzyl(methyl)amino]-2-keto-ethyl]carbamoyl]azetidine-1-carboxylic acid tert-butyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C26H33N3O4/c1-26(2,3)33-25(32)29-16-15-22(29)23(30)27-21(17-19-11-7-5-8-12-19)24(31)28(4)18-20-13-9-6-10-14-20/h5-14,21-22H,15-18H2,1-4H3,(H,27,30)/t21-,22-/m0/s1