4-bromanyl-N-cycloheptyl-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-cycloheptyl-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-cycloheptyl-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-cycloheptyl-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-cycloheptyl-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-cycloheptyl-2,5-dimethyl-pyrazole-3-carboxamide Formula: C13H20BrN3O MolecularWeight: 314.2214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)NC2CCCCCC2)C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)NC2CCCCCC2)C

InChI

InChI=1S/C13H20BrN3O/c1-9-11(14)12(17(2)16-9)13(18)15-10-7-5-3-4-6-8-10/h10H,3-8H2,1-2H3,(H,15,18)