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

Systemtic Name: methyl 2-[(2Z)-2-(5-chloranylthiophen-2-yl)sulfonylimino-6-sulfamoyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C14H12ClN3O6S4 MolecularWeight: 481.97458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=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/C14H12ClN3O6S4/c1-24-12(19)7-18-9-3-2-8(27(16,20)21)6-10(9)25-14(18)17-28(22,23)13-5-4-11(15)26-13/h2-6H,7H2,1H3,(H2,16,20,21)/b17-14-