(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(2-hydroxyethylamino)benzoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(2-hydroxyethylamino)benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-(2-hydroxyethylamino)benzoate CAS Name: 2-(2-hydroxyethylamino)benzoic 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 2-(2-hydroxyethylamino)benzoate Traditional Name: 2-(2-hydroxyethylamino)benzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3)NCCO

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3)NCCO

InChI

InChI=1S/C16H15N3O4S/c20-8-7-17-12-5-2-1-4-11(12)16(21)22-10-14-18-15(19-23-14)13-6-3-9-24-13/h1-6,9,17,20H,7-8,10H2