[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-(2-thienylsulfonylamino)propanoate CAS Name: 3-(thiophen-2-ylsulfonylamino)propanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-(thiophen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-thienylsulfonylamino)propionic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C12H18N2O5S2 MolecularWeight: 334.41172

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)CCNS(=O)(=O)C1=CC=CS1

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)CCNS(=O)(=O)C1=CC=CS1

InChI

InChI=1S/C12H18N2O5S2/c1-3-13-12(16)9(2)19-10(15)6-7-14-21(17,18)11-5-4-8-20-11/h4-5,8-9,14H,3,6-7H2,1-2H3,(H,13,16)/t9-/m0/s1