3-(3-bromophenyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-bromophenyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-[3-[anilino(oxo)methyl]-1-ethyl-4-pyrazolyl]-3-(3-bromophenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-2-isoxazoline-5-carboxamide Formula: C22H20BrN5O3 MolecularWeight: 482.3299

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrN5O3/c1-2-28-13-18(20(26-28)22(30)24-16-9-4-3-5-10-16)25-21(29)19-12-17(27-31-19)14-7-6-8-15(23)11-14/h3-11,13,19H,2,12H2,1H3,(H,24,30)(H,25,29)