N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-ethyl-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C21H27FN6O2 MolecularWeight: 414.476483

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CN2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CN2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C21H27FN6O2/c1-2-27(15-19(29)25-14-17-4-6-18(22)7-5-17)20(30)16-26-10-12-28(13-11-26)21-23-8-3-9-24-21/h3-9H,2,10-16H2,1H3,(H,25,29)