[4-[[4-(cyclopropylcarbonylamino)phenyl]carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[[4-(cyclopropylcarbonylamino)phenyl]carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[[4-(cyclopropanecarbonylamino)phenyl]carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[[4-[[cyclopropyl(oxo)methyl]amino]anilino]-oxomethyl]phenyl] ester IUPAC Name: [4-[[4-(cyclopropanecarbonylamino)phenyl]carbamoyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[[4-(cyclopropanecarbonylamino)phenyl]carbamoyl]phenyl] ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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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)NC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H24N2O5S/c1-16-3-4-17(2)23(15-16)33(30,31)32-22-13-7-19(8-14-22)25(29)27-21-11-9-20(10-12-21)26-24(28)18-5-6-18/h3-4,7-15,18H,5-6H2,1-2H3,(H,26,28)(H,27,29)