5-(4-bromophenyl)-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]isoxazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-[1-[(4-fluorophenyl)methyl]-4-pyrazolyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[1-(4-fluorobenzyl)pyrazol-4-yl]isoxazole-3-carboxamide Formula: C20H14BrFN4O2 MolecularWeight: 441.253163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br)F

InChI

InChI=1S/C20H14BrFN4O2/c21-15-5-3-14(4-6-15)19-9-18(25-28-19)20(27)24-17-10-23-26(12-17)11-13-1-7-16(22)8-2-13/h1-10,12H,11H2,(H,24,27)