2-(4-bromanylpyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]propanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]propanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]propanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[3-(4-morpholinylmethyl)phenyl]propanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]propanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]propionamide Formula: C17H21BrN4O2 MolecularWeight: 393.27824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C=C(C=N3)Br

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C=C(C=N3)Br

InChI

InChI=1S/C17H21BrN4O2/c1-13(22-12-15(18)10-19-22)17(23)20-16-4-2-3-14(9-16)11-21-5-7-24-8-6-21/h2-4,9-10,12-13H,5-8,11H2,1H3,(H,20,23)