[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-ethoxyphenyl)sulfonylamino]propanoate

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-[(4-ethoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]propanoic acid [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-phenetylsulfonylamino)propionic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H25N3O7S MolecularWeight: 415.4613

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)OCC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)OCC

InChI

InChI=1S/C17H25N3O7S/c1-4-18-17(23)20-16(22)12(3)27-15(21)10-11-19-28(24,25)14-8-6-13(7-9-14)26-5-2/h6-9,12,19H,4-5,10-11H2,1-3H3,(H2,18,20,22,23)/t12-/m0/s1