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

Systemtic Name: methyl 3-(2-naphthalen-2-ylcarbonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-[2-(naphthalene-2-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[2-naphthalenyl(oxo)methyl]imino-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(naphthalene-2-carbonylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(2-naphthoylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]propionic acid methyl ester Formula: C22H19N3O5S2 MolecularWeight: 469.53336

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC(=O)CCN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H19N3O5S2/c1-30-20(26)10-11-25-18-9-8-17(32(23,28)29)13-19(18)31-22(25)24-21(27)16-7-6-14-4-2-3-5-15(14)12-16/h2-9,12-13H,10-11H2,1H3,(H2,23,28,29)