[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-[[(E)-styryl]sulfonylamino]propanoate CAS Name: 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Traditional Name: 3-[[(E)-styryl]sulfonylamino]propionic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CS(=O)(=O)NCCC(=O)OCC(=O)NCC2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)/C=C/S(=O)(=O)NCCC(=O)OCC(=O)NCC2=CC=CS2

InChI

InChI=1S/C18H20N2O5S2/c21-17(19-13-16-7-4-11-26-16)14-25-18(22)8-10-20-27(23,24)12-9-15-5-2-1-3-6-15/h1-7,9,11-12,20H,8,10,13-14H2,(H,19,21)/b12-9+