2-[(5-cyano-2-fluoranyl-phenyl)-[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-N,N-diethyl-benzamide

Systemtic Name: 2-[(5-cyano-2-fluoranyl-phenyl)-[1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]-N,N-diethyl-benzamide Openeye Name: 2-(5-cyano-2-fluoro-N-[1-(2-pyridylmethyl)-4-piperidyl]anilino)-N,N-diethyl-benzamide CAS Name: 2-(5-cyano-2-fluoro-N-[1-(2-pyridinylmethyl)-4-piperidinyl]anilino)-N,N-diethylbenzamide IUPAC Name: 2-(5-cyano-2-fluoro-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]anilino)-N,N-diethylbenzamide Traditional Name: 2-(5-cyano-2-fluoro-N-[1-(2-pyridylmethyl)-4-piperidyl]anilino)-N,N-diethyl-benzamide Formula: C29H32FN5O MolecularWeight: 485.595683

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC=C1N(C2CCN(CC2)CC3=CC=CC=N3)C4=C(C=CC(=C4)C#N)F

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC=C1N(C2CCN(CC2)CC3=CC=CC=N3)C4=C(C=CC(=C4)C#N)F

InChI

InChI=1S/C29H32FN5O/c1-3-34(4-2)29(36)25-10-5-6-11-27(25)35(28-19-22(20-31)12-13-26(28)30)24-14-17-33(18-15-24)21-23-9-7-8-16-32-23/h5-13,16,19,24H,3-4,14-15,17-18,21H2,1-2H3