4-[2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propanoylamino]benzamide

Systemtic Name: 4-[2-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propanoylamino]benzamide Openeye Name: 4-[2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]propanoylamino]benzamide CAS Name: 4-[[2-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[2-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]propanoylamino]benzamide Traditional Name: 4-[2-[4-(2-chloro-4-fluoro-benzyl)piperazino]propanoylamino]benzamide Formula: C21H24ClFN4O2 MolecularWeight: 418.892263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H24ClFN4O2/c1-14(21(29)25-18-6-3-15(4-7-18)20(24)28)27-10-8-26(9-11-27)13-16-2-5-17(23)12-19(16)22/h2-7,12,14H,8-11,13H2,1H3,(H2,24,28)(H,25,29)