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

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(piazthiol-4-ylsulfonylamino)propionamide Formula: C18H17N5O4S3 MolecularWeight: 463.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H17N5O4S3/c1-2-27-11-6-7-12-14(10-11)28-18(20-12)21-16(24)8-9-19-30(25,26)15-5-3-4-13-17(15)23-29-22-13/h3-7,10,19H,2,8-9H2,1H3,(H,20,21,24)