N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C20H20BrN5O2 MolecularWeight: 442.3091

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)C3=NC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C20H20BrN5O2/c21-16-3-1-2-4-17(16)25-19(27)13-24-20(28)15-7-9-26(10-8-15)18-6-5-14(11-22)12-23-18/h1-6,12,15H,7-10,13H2,(H,24,28)(H,25,27)