4-(4-bromanylpyrazol-1-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-(2-phenyl-2-pyrrolidino-ethyl)benzamide Formula: C22H23BrN4O MolecularWeight: 439.34822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H23BrN4O/c23-19-14-25-27(16-19)20-10-8-18(9-11-20)22(28)24-15-21(26-12-4-5-13-26)17-6-2-1-3-7-17/h1-3,6-11,14,16,21H,4-5,12-13,15H2,(H,24,28)