1-[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: 1-[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[2-[2-[(4-bromophenyl)thio]ethylamino]-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[2-(4-bromophenyl)sulfanylethylamino]-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-[2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-ethyl]isonipecotamide Formula: C16H22BrN3O2S MolecularWeight: 400.33378

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)CC(=O)NCCSC2=CC=C(C=C2)Br

Isomeric SMILES

C1CN(CCC1C(=O)N)CC(=O)NCCSC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H22BrN3O2S/c17-13-1-3-14(4-2-13)23-10-7-19-15(21)11-20-8-5-12(6-9-20)16(18)22/h1-4,12H,5-11H2,(H2,18,22)(H,19,21)