[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoate CAS Name: 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-[(4-chlorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(4-chlorophenyl)sulfamoyl]benzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C22H17BrClNO5S2 MolecularWeight: 554.86108

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C=CCN(C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C22H17BrClNO5S2/c1-2-12-25(17-8-6-16(24)7-9-17)32(28,29)18-5-3-4-15(13-18)22(27)30-14-19(26)20-10-11-21(23)31-20/h2-11,13H,1,12,14H2