ethyl 3-[6-sulfamoyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylimino)-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[6-sulfamoyl-2-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[6-sulfamoyl-2-(tetralin-6-carbonylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[oxo(5,6,7,8-tetrahydronaphthalen-2-yl)methyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-sulfamoyl-2-(5,6,7,8-tetrahydronaphthalene-2-carbonylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[6-sulfamoyl-2-(tetralin-6-carbonylimino)-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H25N3O5S2/c1-2-31-21(27)11-12-26-19-10-9-18(33(24,29)30)14-20(19)32-23(26)25-22(28)17-8-7-15-5-3-4-6-16(15)13-17/h7-10,13-14H,2-6,11-12H2,1H3,(H2,24,29,30)