4,5-bis(bromanyl)-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide

Systemtic Name: 4,5-bis(bromanyl)-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide Openeye Name: 4,5-dibromo-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide CAS Name: 4,5-dibromo-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide IUPAC Name: 4,5-dibromo-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide Traditional Name: 4,5-dibromo-N-(1-phenylpropyl)-1H-pyrazole-3-carboxamide Formula: C13H13Br2N3O MolecularWeight: 387.06982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=NNC(=C2Br)Br

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)C2=NNC(=C2Br)Br

InChI

InChI=1S/C13H13Br2N3O/c1-2-9(8-6-4-3-5-7-8)16-13(19)11-10(14)12(15)18-17-11/h3-7,9H,2H2,1H3,(H,16,19)(H,17,18)