N-[3-[4-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-oxidanyl-propyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-[4-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-oxidanyl-propyl]-2-fluoranyl-benzamide Openeye Name: N-[3-[4-[2-(cyclohexylamino)-2-oxo-ethyl]piperazin-1-yl]-2-hydroxy-propyl]-2-fluoro-benzamide CAS Name: N-[3-[4-[2-(cyclohexylamino)-2-oxoethyl]-1-piperazinyl]-2-hydroxypropyl]-2-fluorobenzamide IUPAC Name: N-[3-[4-[2-(cyclohexylamino)-2-oxoethyl]piperazin-1-yl]-2-hydroxypropyl]-2-fluorobenzamide Traditional Name: N-[3-[4-[2-(cyclohexylamino)-2-keto-ethyl]piperazino]-2-hydroxy-propyl]-2-fluoro-benzamide Formula: C22H33FN4O3 MolecularWeight: 420.520823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN2CCN(CC2)CC(CNC(=O)C3=CC=CC=C3F)O

Isomeric SMILES

C1CCC(CC1)NC(=O)CN2CCN(CC2)CC(CNC(=O)C3=CC=CC=C3F)O

InChI

InChI=1S/C22H33FN4O3/c23-20-9-5-4-8-19(20)22(30)24-14-18(28)15-26-10-12-27(13-11-26)16-21(29)25-17-6-2-1-3-7-17/h4-5,8-9,17-18,28H,1-3,6-7,10-16H2,(H,24,30)(H,25,29)