[2-oxidanylidene-2-(propylamino)ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: [2-oxo-2-(propylamino)ethyl] (2S)-4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2S)-4-methyl-2-(tosylamino)valeric acid [2-keto-2-(propylamino)ethyl] ester Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCNC(=O)COC(=O)[C@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C18H28N2O5S/c1-5-10-19-17(21)12-25-18(22)16(11-13(2)3)20-26(23,24)15-8-6-14(4)7-9-15/h6-9,13,16,20H,5,10-12H2,1-4H3,(H,19,21)/t16-/m0/s1