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

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-(5-cyanopyridin-2-yl)-N-methyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-1-(5-cyano-2-pyridyl)-N-methyl-piperidine-4-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(5-cyano-2-pyridinyl)-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(5-cyanopyridin-2-yl)-N-methylpiperidine-4-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-1-(5-cyano-2-pyridyl)-N-methyl-isonipecotamide Formula: C21H22BrN5O2 MolecularWeight: 456.33568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C21H22BrN5O2/c1-26(14-20(28)25-18-5-3-2-4-17(18)22)21(29)16-8-10-27(11-9-16)19-7-6-15(12-23)13-24-19/h2-7,13,16H,8-11,14H2,1H3,(H,25,28)