(2-phenyl-1,3-thiazol-4-yl)methyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate Traditional Name: 2-(piazthiol-4-ylsulfonylamino)propionic acid (2-phenylthiazol-4-yl)methyl ester Formula: C19H16N4O4S3 MolecularWeight: 460.54974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CSC(=N1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC(C(=O)OCC1=CSC(=N1)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C19H16N4O4S3/c1-12(23-30(25,26)16-9-5-8-15-17(16)22-29-21-15)19(24)27-10-14-11-28-18(20-14)13-6-3-2-4-7-13/h2-9,11-12,23H,10H2,1H3