3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-methoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(piazthiol-4-ylsulfonylamino)propionamide Formula: C17H15N5O4S3 MolecularWeight: 449.5271

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H15N5O4S3/c1-26-10-5-6-11-13(9-10)27-17(19-11)20-15(23)7-8-18-29(24,25)14-4-2-3-12-16(14)22-28-21-12/h2-6,9,18H,7-8H2,1H3,(H,19,20,23)