N-[(3-bromophenyl)methyl]-2-[[3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(3-bromophenyl)methyl]-2-[[3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-2-[[3-(4-methoxyphenyl)-4,5-dihydroisoxazol-5-yl]methyl]-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-2-[[3-(4-methoxyphenyl)-4,5-dihydroisoxazol-5-yl]methyl]-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-2-[[3-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-5-phenylpyrazole-3-carboxamide Traditional Name: N-(3-bromobenzyl)-2-[[3-(4-methoxyphenyl)-2-isoxazolin-5-yl]methyl]-5-phenyl-pyrazole-3-carboxamide Formula: C28H25BrN4O3 MolecularWeight: 545.4271

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(C2)CN3C(=CC(=N3)C4=CC=CC=C4)C(=O)NCC5=CC(=CC=C5)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(C2)CN3C(=CC(=N3)C4=CC=CC=C4)C(=O)NCC5=CC(=CC=C5)Br

InChI

InChI=1S/C28H25BrN4O3/c1-35-23-12-10-21(11-13-23)26-15-24(36-32-26)18-33-27(16-25(31-33)20-7-3-2-4-8-20)28(34)30-17-19-6-5-9-22(29)14-19/h2-14,16,24H,15,17-18H2,1H3,(H,30,34)