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

Systemtic Name: 5-(4-bromophenyl)-N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[2-(p-tolylmethyl)pyrazol-3-yl]isoxazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-[2-[(4-methylphenyl)methyl]-3-pyrazolyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[2-[(4-methylphenyl)methyl]pyrazol-3-yl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[2-(4-methylbenzyl)pyrazol-3-yl]isoxazole-3-carboxamide Formula: C21H17BrN4O2 MolecularWeight: 437.28928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN4O2/c1-14-2-4-15(5-3-14)13-26-20(10-11-23-26)24-21(27)18-12-19(28-25-18)16-6-8-17(22)9-7-16/h2-12H,13H2,1H3,(H,24,27)