N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-ethanoylpiperazin-1-yl)phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)-3-chloro-phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[4-(4-acetylpiperazino)-3-chloro-phenyl]-4-cyano-2-fluoro-benzamide Formula: C20H18ClFN4O2 MolecularWeight: 400.833923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl

InChI

InChI=1S/C20H18ClFN4O2/c1-13(27)25-6-8-26(9-7-25)19-5-3-15(11-17(19)21)24-20(28)16-4-2-14(12-23)10-18(16)22/h2-5,10-11H,6-9H2,1H3,(H,24,28)