(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCC(=O)OCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCC(=O)OCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H17N3O5S2/c24-19(27-13-18-22-20(23-28-18)17-6-3-11-29-17)9-10-21-30(25,26)16-8-7-14-4-1-2-5-15(14)12-16/h1-8,11-12,21H,9-10,13H2