N-(4-bromanyl-3-methyl-phenyl)-3-pyrazol-1-yl-propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-pyrazol-1-yl-propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-pyrazol-1-yl-propanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-(1-pyrazolyl)propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-pyrazol-1-ylpropanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-pyrazol-1-yl-propionamide Formula: C13H14BrN3O MolecularWeight: 308.17376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCN2C=CC=N2)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCN2C=CC=N2)Br

InChI

InChI=1S/C13H14BrN3O/c1-10-9-11(3-4-12(10)14)16-13(18)5-8-17-7-2-6-15-17/h2-4,6-7,9H,5,8H2,1H3,(H,16,18)