1-[(4-bromophenyl)methylsulfonyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)sulfonyl-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)isonipecotamide Formula: C24H30BrN3O6S2 MolecularWeight: 600.5455

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H30BrN3O6S2/c1-34-23-9-8-21(36(32,33)28-12-2-3-13-28)16-22(23)26-24(29)19-10-14-27(15-11-19)35(30,31)17-18-4-6-20(25)7-5-18/h4-9,16,19H,2-3,10-15,17H2,1H3,(H,26,29)