tert-butyl N-[(2S)-1-[2-cyanoethyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[2-cyanoethyl-(phenylmethyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-[benzyl(2-cyanoethyl)amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[2-cyanoethyl-(phenylmethyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[benzyl(2-cyanoethyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-[benzyl(2-cyanoethyl)amino]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C24H29N3O3/c1-24(2,3)30-23(29)26-21(17-19-11-6-4-7-12-19)22(28)27(16-10-15-25)18-20-13-8-5-9-14-20/h4-9,11-14,21H,10,16-18H2,1-3H3,(H,26,29)/t21-/m0/s1