2-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)ethanamide

Systemtic Name: 2-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)ethanamide Openeye Name: 2-[1-[(2-chloro-4-fluoro-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide CAS Name: 2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxo-2-piperazinyl]-N-ethyl-N-[2-(1-pyrazolyl)ethyl]acetamide IUPAC Name: 2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxopiperazin-2-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide Traditional Name: 2-[1-(2-chloro-4-fluoro-benzyl)-3-keto-piperazin-2-yl]-N-ethyl-N-(2-pyrazol-1-ylethyl)acetamide Formula: C20H25ClFN5O2 MolecularWeight: 421.896203

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN1C=CC=N1)C(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CCN(CCN1C=CC=N1)C(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C20H25ClFN5O2/c1-2-25(10-11-27-8-3-6-24-27)19(28)13-18-20(29)23-7-9-26(18)14-15-4-5-16(22)12-17(15)21/h3-6,8,12,18H,2,7,9-11,13-14H2,1H3,(H,23,29)