N-(4-bromanyl-2-fluoranyl-phenyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C18H17BrFN5OS MolecularWeight: 450.327883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Br)F)C3=NN=C(S3)N4C=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Br)F)C3=NN=C(S3)N4C=CC=C4

InChI

InChI=1S/C18H17BrFN5OS/c19-13-3-4-15(14(20)11-13)21-16(26)12-5-9-25(10-6-12)18-23-22-17(27-18)24-7-1-2-8-24/h1-4,7-8,11-12H,5-6,9-10H2,(H,21,26)