3-bromanyl-N-[2-oxidanylidene-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-oxidanylidene-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide Openeye Name: 3-bromo-N-[2-oxo-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide CAS Name: 3-bromo-N-[2-oxo-2-[3-(1-pyrazolyl)propylamino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-oxo-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide Formula: C15H17BrN4O2 MolecularWeight: 365.22508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)NCCCN2C=CC=N2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)NCCCN2C=CC=N2

InChI

InChI=1S/C15H17BrN4O2/c16-13-5-1-4-12(10-13)15(22)18-11-14(21)17-6-2-8-20-9-3-7-19-20/h1,3-5,7,9-10H,2,6,8,11H2,(H,17,21)(H,18,22)