(2R)-1-(4-bromophenyl)sulfonyl-N-[4-[(4-methoxyphenyl)carbonylamino]cyclohexyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(4-bromophenyl)sulfonyl-N-[4-[(4-methoxyphenyl)carbonylamino]cyclohexyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(4-bromophenyl)sulfonyl-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-(4-bromophenyl)sulfonyl-N-[4-[[(4-methoxyphenyl)-oxomethyl]amino]cyclohexyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(4-bromophenyl)sulfonyl-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-brosyl-N-[4-(p-anisoylamino)cyclohexyl]pyrrolidine-2-carboxamide Formula: C25H30BrN3O5S MolecularWeight: 564.4918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CCC(CC2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CCC(CC2)NC(=O)[C@H]3CCCN3S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H30BrN3O5S/c1-34-21-12-4-17(5-13-21)24(30)27-19-8-10-20(11-9-19)28-25(31)23-3-2-16-29(23)35(32,33)22-14-6-18(26)7-15-22/h4-7,12-15,19-20,23H,2-3,8-11,16H2,1H3,(H,27,30)(H,28,31)/t19?,20?,23-/m1/s1