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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-(4-cyanophenyl)piperazine-1-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-(4-cyanophenyl)piperazine-1-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-(4-cyanophenyl)-1-piperazinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-(4-cyanophenyl)piperazine-1-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-(4-cyanophenyl)piperazine-1-carboxamide Formula: C18H16BrFN4O MolecularWeight: 403.248243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C18H16BrFN4O/c19-14-3-6-17(16(20)11-14)22-18(25)24-9-7-23(8-10-24)15-4-1-13(12-21)2-5-15/h1-6,11H,7-10H2,(H,22,25)