[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCC(=O)OCC(=O)NCC3=CC=CS3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCC(=O)OCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H20N2O5S2/c23-19(21-13-17-6-3-11-28-17)14-27-20(24)9-10-22-29(25,26)18-8-7-15-4-1-2-5-16(15)12-18/h1-8,11-12,22H,9-10,13-14H2,(H,21,23)