N-(3-bromophenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-(2-pyrimidyl)isonipecotamide Formula: C16H17BrN4O MolecularWeight: 361.23638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=CC=C2)Br)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=CC=C2)Br)C3=NC=CC=N3

InChI

InChI=1S/C16H17BrN4O/c17-13-3-1-4-14(11-13)20-15(22)12-5-9-21(10-6-12)16-18-7-2-8-19-16/h1-4,7-8,11-12H,5-6,9-10H2,(H,20,22)