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

Systemtic Name: 3-(3-bromophenyl)-N-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-[1-(p-tolylmethyl)pyrazol-3-yl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-bromophenyl)-N-[1-[(4-methylphenyl)methyl]-3-pyrazolyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-[1-[(4-methylphenyl)methyl]pyrazol-3-yl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-[1-(4-methylbenzyl)pyrazol-3-yl]-2-isoxazoline-5-carboxamide Formula: C21H19BrN4O2 MolecularWeight: 439.30516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC(=N2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC(=N2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H19BrN4O2/c1-14-5-7-15(8-6-14)13-26-10-9-20(24-26)23-21(27)19-12-18(25-28-19)16-3-2-4-17(22)11-16/h2-11,19H,12-13H2,1H3,(H,23,24,27)