[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(dibenzylamino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-[bis(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(dibenzylamino)-2-oxoethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-(dibenzylamino)-2-keto-ethyl] ester Formula: C27H23BrN2O5S2 MolecularWeight: 599.51592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C27H23BrN2O5S2/c28-24-15-16-26(36-24)37(33,34)29-23-14-8-7-13-22(23)27(32)35-19-25(31)30(17-20-9-3-1-4-10-20)18-21-11-5-2-6-12-21/h1-16,29H,17-19H2