tert-butyl N-[2-[2,1,3-benzothiadiazol-4-ylsulfonyl(phenyl)amino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[2,1,3-benzothiadiazol-4-ylsulfonyl(phenyl)amino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[N-(2,1,3-benzothiadiazol-4-ylsulfonyl)anilino]ethyl]carbamate CAS Name: N-[2-[N-(2,1,3-benzothiadiazol-4-ylsulfonyl)anilino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[N-(2,1,3-benzothiadiazol-4-ylsulfonyl)anilino]ethyl]carbamate Traditional Name: N-[2-(N-piazthiol-4-ylsulfonylanilino)ethyl]carbamic acid tert-butyl ester Formula: C19H22N4O4S2 MolecularWeight: 434.53238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)(C)OC(=O)NCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C19H22N4O4S2/c1-19(2,3)27-18(24)20-12-13-23(14-8-5-4-6-9-14)29(25,26)16-11-7-10-15-17(16)22-28-21-15/h4-11H,12-13H2,1-3H3,(H,20,24)