N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-[3-(4-bromopyrazol-1-yl)propyl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-bromophenyl)-N-[3-(4-bromo-1-pyrazolyl)propyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-[3-(4-bromopyrazol-1-yl)propyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-[3-(4-bromopyrazol-1-yl)propyl]-2-isoxazoline-5-carboxamide Formula: C16H16Br2N4O2 MolecularWeight: 456.13184

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC(=CC=C2)Br)C(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

C1C(ON=C1C2=CC(=CC=C2)Br)C(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C16H16Br2N4O2/c17-12-4-1-3-11(7-12)14-8-15(24-21-14)16(23)19-5-2-6-22-10-13(18)9-20-22/h1,3-4,7,9-10,15H,2,5-6,8H2,(H,19,23)