1-[(4-bromophenyl)methylsulfonyl]-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-N-[3-(1-pyrrolidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(4-bromobenzyl)sulfonyl-N-(3-pyrrolidinopropyl)isonipecotamide Formula: C20H30BrN3O3S MolecularWeight: 472.4395

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H30BrN3O3S/c21-19-6-4-17(5-7-19)16-28(26,27)24-14-8-18(9-15-24)20(25)22-10-3-13-23-11-1-2-12-23/h4-7,18H,1-3,8-16H2,(H,22,25)