1-(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxamide

Systemtic Name: 1-(2-bromanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxamide Openeye Name: 1-(2-bromo-5-pyrrolidin-1-ylsulfonyl-benzoyl)piperidine-4-carboxamide CAS Name: 1-[[2-bromo-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-bromo-5-pyrrolidin-1-ylsulfonylbenzoyl)piperidine-4-carboxamide Traditional Name: 1-(2-bromo-5-pyrrolidinosulfonyl-benzoyl)isonipecotamide Formula: C17H22BrN3O4S MolecularWeight: 444.34328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H22BrN3O4S/c18-15-4-3-13(26(24,25)21-7-1-2-8-21)11-14(15)17(23)20-9-5-12(6-10-20)16(19)22/h3-4,11-12H,1-2,5-10H2,(H2,19,22)