ethyl 3-(2-naphthalen-1-ylcarbonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 3-(2-naphthalen-1-ylcarbonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 3-[2-(naphthalene-1-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[1-naphthalenyl(oxo)methyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(naphthalene-1-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(1-naphthoylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C23H21N3O5S2 MolecularWeight: 483.55994

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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=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H21N3O5S2/c1-2-31-21(27)12-13-26-19-11-10-16(33(24,29)30)14-20(19)32-23(26)25-22(28)18-9-5-7-15-6-3-4-8-17(15)18/h3-11,14H,2,12-13H2,1H3,(H2,24,29,30)