2-[4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[2-[(4-ethoxyphenyl)amino]pyridin-3-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[2-(4-ethoxyanilino)-3-pyridinyl]-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[2-(4-ethoxyanilino)pyridine-3-carbonyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 1-piperidino-2-[4-[2-(p-phenetidino)nicotinoyl]piperazino]ethanone Formula: C25H33N5O3 MolecularWeight: 451.56122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C=CC=N2)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C25H33N5O3/c1-2-33-21-10-8-20(9-11-21)27-24-22(7-6-12-26-24)25(32)30-17-15-28(16-18-30)19-23(31)29-13-4-3-5-14-29/h6-12H,2-5,13-19H2,1H3,(H,26,27)