3-(3-bromophenyl)-N-(1-ethyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-bromophenyl)-N-(1-ethyl-5-morpholin-4-ylcarbonyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-bromophenyl)-N-[1-ethyl-5-[4-morpholinyl(oxo)methyl]-4-pyrazolyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-2-isoxazoline-5-carboxamide Formula: C20H22BrN5O4 MolecularWeight: 476.32378

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br)C(=O)N4CCOCC4

Isomeric SMILES

CCN1C(=C(C=N1)NC(=O)C2CC(=NO2)C3=CC(=CC=C3)Br)C(=O)N4CCOCC4

InChI

InChI=1S/C20H22BrN5O4/c1-2-26-18(20(28)25-6-8-29-9-7-25)16(12-22-26)23-19(27)17-11-15(24-30-17)13-4-3-5-14(21)10-13/h3-5,10,12,17H,2,6-9,11H2,1H3,(H,23,27)