N-(4-bromanyl-2-fluoranyl-phenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-(4-pyridylmethyl)piperazine-1-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-(pyridin-4-ylmethyl)-1-piperazinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-(pyridin-4-ylmethyl)piperazine-1-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-(4-pyridylmethyl)piperazine-1-carboxamide Formula: C17H18BrFN4O MolecularWeight: 393.253423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H18BrFN4O/c18-14-1-2-16(15(19)11-14)21-17(24)23-9-7-22(8-10-23)12-13-3-5-20-6-4-13/h1-6,11H,7-10,12H2,(H,21,24)