4-(6-chloranylpyridin-3-yl)carbonyl-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(6-chloranylpyridin-3-yl)carbonyl-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(6-chloropyridine-3-carbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide CAS Name: 4-[(6-chloro-3-pyridinyl)-oxomethyl]-N-[(4-fluorophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(6-chloropyridine-3-carbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(6-chloronicotinoyl)-N-(4-fluorobenzyl)piperazine-1-carboxamide Formula: C18H18ClFN4O2 MolecularWeight: 376.812523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CN=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CN=C(C=C2)Cl)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18ClFN4O2/c19-16-6-3-14(12-21-16)17(25)23-7-9-24(10-8-23)18(26)22-11-13-1-4-15(20)5-2-13/h1-6,12H,7-11H2,(H,22,26)