1-[2-[(3-bromophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3-bromophenyl)-(phenylsulfonyl)amino]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[N-(benzenesulfonyl)-3-bromo-anilino]acetyl]piperidine-4-carboxamide CAS Name: 1-[2-[N-(benzenesulfonyl)-3-bromoanilino]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[N-(benzenesulfonyl)-3-bromoanilino]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-(N-besyl-3-bromo-anilino)acetyl]isonipecotamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O4S/c21-16-5-4-6-17(13-16)24(29(27,28)18-7-2-1-3-8-18)14-19(25)23-11-9-15(10-12-23)20(22)26/h1-8,13,15H,9-12,14H2,(H2,22,26)