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

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (2S)-4-methyl-2-(p-tolylsulfonylamino)pentanoate CAS Name: (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: (2S)-4-methyl-2-(tosylamino)valeric acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OCC(=O)NC(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC(C)C)C(=O)OCC(=O)NC(=O)NC

InChI

InChI=1S/C17H25N3O6S/c1-11(2)9-14(16(22)26-10-15(21)19-17(23)18-4)20-27(24,25)13-7-5-12(3)6-8-13/h5-8,11,14,20H,9-10H2,1-4H3,(H2,18,19,21,23)/t14-/m0/s1