2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid 2-phthalimidoethyl ester Formula: C21H15BrN2O6S2 MolecularWeight: 535.3876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCOC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C21H15BrN2O6S2/c22-17-9-10-18(31-17)32(28,29)23-16-8-4-3-7-15(16)21(27)30-12-11-24-19(25)13-5-1-2-6-14(13)20(24)26/h1-10,23H,11-12H2