N-(4-bromophenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-bromophenyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-bromophenyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(4-bromophenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-bromophenyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C17H18BrN3O3S MolecularWeight: 424.31212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)Br)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)Br)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H18BrN3O3S/c18-14-3-5-15(6-4-14)20-17(22)13-7-10-21(11-8-13)25(23,24)16-2-1-9-19-12-16/h1-6,9,12-13H,7-8,10-11H2,(H,20,22)