[4-[2-[(2-chlorophenyl)carbonylamino]ethylcarbamoyl]phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[2-[(2-chlorophenyl)carbonylamino]ethylcarbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[2-[(2-chlorobenzoyl)amino]ethylcarbamoyl]phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[[2-[[(2-chlorophenyl)-oxomethyl]amino]ethylamino]-oxomethyl]phenyl] ester IUPAC Name: [4-[2-[(2-chlorobenzoyl)amino]ethylcarbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[2-[(2-chlorobenzoyl)amino]ethylcarbamoyl]phenyl] ester Formula: C24H23ClN2O5S MolecularWeight: 486.96782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NCCNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NCCNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C24H23ClN2O5S/c1-16-7-8-17(2)22(15-16)33(30,31)32-19-11-9-18(10-12-19)23(28)26-13-14-27-24(29)20-5-3-4-6-21(20)25/h3-12,15H,13-14H2,1-2H3,(H,26,28)(H,27,29)