ethyl (3R)-3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(4-methylphenyl)propanoate

Systemtic Name: ethyl (3R)-3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(4-methylphenyl)propanoate Openeye Name: ethyl (3R)-3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(p-tolyl)propanoate CAS Name: (3R)-3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(4-methylphenyl)propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(4-methylphenyl)propanoate Traditional Name: (3R)-3-(piazthiol-4-ylsulfonylamino)-3-(p-tolyl)propionic acid ethyl ester Formula: C18H19N3O4S2 MolecularWeight: 405.49116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCOC(=O)C[C@H](C1=CC=C(C=C1)C)NS(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H19N3O4S2/c1-3-25-17(22)11-15(13-9-7-12(2)8-10-13)21-27(23,24)16-6-4-5-14-18(16)20-26-19-14/h4-10,15,21H,3,11H2,1-2H3/t15-/m1/s1