tert-butyl (4S)-1-methyl-3-[(2S)-4-methyl-2-[(phenylmethyl)amino]pentanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate

Systemtic Name: tert-butyl (4S)-1-methyl-3-[(2S)-4-methyl-2-[(phenylmethyl)amino]pentanoyl]-2-oxidanylidene-imidazolidine-4-carboxylate Openeye Name: tert-butyl (4S)-3-[(2S)-2-(benzylamino)-4-methyl-pentanoyl]-1-methyl-2-oxo-imidazolidine-4-carboxylate CAS Name: (4S)-1-methyl-3-[(2S)-4-methyl-1-oxo-2-[(phenylmethyl)amino]pentyl]-2-oxo-4-imidazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-3-[(2S)-2-(benzylamino)-4-methylpentanoyl]-1-methyl-2-oxoimidazolidine-4-carboxylate Traditional Name: (4S)-3-[(2S)-2-(benzylamino)-4-methyl-pentanoyl]-2-keto-1-methyl-imidazolidine-4-carboxylic acid tert-butyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1C(CN(C1=O)C)C(=O)OC(C)(C)C)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1[C@@H](CN(C1=O)C)C(=O)OC(C)(C)C)NCC2=CC=CC=C2

InChI

InChI=1S/C22H33N3O4/c1-15(2)12-17(23-13-16-10-8-7-9-11-16)19(26)25-18(14-24(6)21(25)28)20(27)29-22(3,4)5/h7-11,15,17-18,23H,12-14H2,1-6H3/t17-,18-/m0/s1