ethyl 2-[(2Z)-2-(5-chloranylthiophen-2-yl)sulfonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2Z)-2-(5-chloranylthiophen-2-yl)sulfonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[(2Z)-2-[(5-chloro-2-thienyl)sulfonylimino]-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[(2Z)-2-[(5-chloro-2-thiophenyl)sulfonylimino]-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2Z)-2-(5-chlorothiophen-2-yl)sulfonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[(2Z)-2-[(5-chloro-2-thienyl)sulfonylimino]-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C15H14ClN3O6S4 MolecularWeight: 496.00116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)N)SC1=NS(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC(=O)CN\1C2=C(C=C(C=C2)S(=O)(=O)N)S/C1=N\S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H14ClN3O6S4/c1-2-25-13(20)8-19-10-4-3-9(28(17,21)22)7-11(10)26-15(19)18-29(23,24)14-6-5-12(16)27-14/h3-7H,2,8H2,1H3,(H2,17,21,22)/b18-15-