3-(4-bromanylpyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]-2-methyl-propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-2-methyl-N-[1-(4-sec-butylphenyl)propyl]propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-N-[1-(4-butan-2-ylphenyl)propyl]-2-methylpropanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-N-[1-(4-butan-2-ylphenyl)propyl]-2-methylpropanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-2-methyl-N-[1-(4-sec-butylphenyl)propyl]propionamide Formula: C20H28BrN3O MolecularWeight: 406.35982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)CN2C=C(C=N2)Br

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C(C)CN2C=C(C=N2)Br

InChI

InChI=1S/C20H28BrN3O/c1-5-14(3)16-7-9-17(10-8-16)19(6-2)23-20(25)15(4)12-24-13-18(21)11-22-24/h7-11,13-15,19H,5-6,12H2,1-4H3,(H,23,25)