2-(3-chloranylphenoxy)-1-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-(3-chloranylphenoxy)-1-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone Openeye Name: 2-(3-chlorophenoxy)-1-[4-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]ethanone CAS Name: 2-(3-chlorophenoxy)-1-[4-[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-chlorophenoxy)-1-[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]ethanone Traditional Name: 2-(3-chlorophenoxy)-1-[4-[6-(4-methylpiperidino)pyrimidin-4-yl]piperazino]ethanone Formula: C22H28ClN5O2 MolecularWeight: 429.94302

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)COC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)COC4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H28ClN5O2/c1-17-5-7-26(8-6-17)20-14-21(25-16-24-20)27-9-11-28(12-10-27)22(29)15-30-19-4-2-3-18(23)13-19/h2-4,13-14,16-17H,5-12,15H2,1H3