[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] (2R)-2-[(4-tert-butylphenyl)carbonylamino]-4-methylsulfonyl-butanoate

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] (2R)-2-[(4-tert-butylphenyl)carbonylamino]-4-methylsulfonyl-butanoate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] (2R)-2-[(4-tert-butylbenzoyl)amino]-4-methylsulfonyl-butanoate CAS Name: (2R)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] (2R)-2-[(4-tert-butylbenzoyl)amino]-4-methylsulfonylbutanoate Traditional Name: (2R)-2-[(4-tert-butylbenzoyl)amino]-4-mesyl-butyric acid [(1S)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C(CCS(=O)(=O)C)NC(=O)C1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N)OC(=O)[C@@H](CCS(=O)(=O)C)NC(=O)C1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C19H28N2O6S/c1-12(16(20)22)27-18(24)15(10-11-28(5,25)26)21-17(23)13-6-8-14(9-7-13)19(2,3)4/h6-9,12,15H,10-11H2,1-5H3,(H2,20,22)(H,21,23)/t12-,15+/m0/s1