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

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[3-(4-morpholinylmethyl)phenyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]butyramide Formula: C18H23BrN4O2 MolecularWeight: 407.30482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrN4O2/c1-2-17(23-13-15(19)11-20-23)18(24)21-16-5-3-4-14(10-16)12-22-6-8-25-9-7-22/h3-5,10-11,13,17H,2,6-9,12H2,1H3,(H,21,24)